3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine; 5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione; (2S)-1-[2-[[(5S,7R)-3-oxidanyl-1-adamantyl]amino]ethanoyl]pyrrolidine-2-carbonitrile

Systemtic Name: 3-[bis(azanyl)methylidene]-1,1-dimethyl-guanidine; 5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione; (2S)-1-[2-[[(5S,7R)-3-oxidanyl-1-adamantyl]amino]ethanoyl]pyrrolidine-2-carbonitrile Openeye Name: 3-(diaminomethylene)-1,1-dimethyl-guanidine; 5-[[4-[2-(5-ethyl-2-pyridyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione; (2S)-1-[2-[[(5S,7R)-3-hydroxy-1-adamantyl]amino]acetyl]pyrrolidine-2-carbonitrile CAS Name: 3-(diaminomethylidene)-1,1-dimethylguanidine; 5-[[4-[2-(5-ethyl-2-pyridinyl)ethoxy]phenyl]methyl]thiazolidine-2,4-dione; (2S)-1-[2-[[(5S,7R)-3-hydroxy-1-adamantyl]amino]-1-oxoethyl]-2-pyrrolidinecarbonitrile IUPAC Name: 3-(diaminomethylidene)-1,1-dimethylguanidine; 5-[[4-[2-(5-ethylpyridin-2-yl)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione; (2S)-1-[2-[[(5S,7R)-3-hydroxy-1-adamantyl]amino]acetyl]pyrrolidine-2-carbonitrile Traditional Name: 3-(diaminomethylene)-1,1-dimethyl-guanidine; 5-[4-[2-(5-ethyl-2-pyridyl)ethoxy]benzyl]thiazolidine-2,4-quinone; (2S)-1-[2-[[(5S,7R)-3-hydroxy-1-adamantyl]amino]acetyl]pyrrolidine-2-carbonitrile Formula: C40H56N10O5S MolecularWeight: 789.00164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC3C(=O)NC(=O)S3.CN(C)C(=N)N=C(N)N.C1CC(N(C1)C(=O)CNC23CC4CC(C2)CC(C4)(C3)O)C#N

Isomeric SMILES

CCC1=CN=C(C=C1)CCOC2=CC=C(C=C2)CC3C(=O)NC(=O)S3.CN(C)C(=N)N=C(N)N.C1C[C@H](N(C1)C(=O)CNC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O)C#N

InChI

InChI=1S/C19H20N2O3S.C17H25N3O2.C4H11N5/c1-2-13-3-6-15(20-12-13)9-10-24-16-7-4-14(5-8-16)11-17-18(22)21-19(23)25-17;18-9-14-2-1-3-20(14)15(21)10-19-16-5-12-4-13(6-16)8-17(22,7-12)11-16;1-9(2)4(7)8-3(5)6/h3-8,12,17H,2,9-11H2,1H3,(H,21,22,23);12-14,19,22H,1-8,10-11H2;1-2H3,(H5,5,6,7,8)/t;12-,13+,14-,16?,17?;/m.0./s1