N-[5-[(3R)-1-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[5-[(3R)-1-(2-methoxy-5-methyl-phenyl)-5-oxidanylidene-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide Openeye Name: N-[5-[(3R)-1-(2-methoxy-5-methyl-phenyl)-5-oxo-pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide CAS Name: N-[5-[(3R)-1-(2-methoxy-5-methylphenyl)-5-oxo-3-pyrrolidinyl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide IUPAC Name: N-[5-[(3R)-1-(2-methoxy-5-methylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide Traditional Name: N-[5-[(3R)-5-keto-1-(2-methoxy-5-methyl-phenyl)pyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl]cyclohexanecarboxamide Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2CC(CC2=O)C3=NN=C(S3)NC(=O)C4CCCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C[C@@H](CC2=O)C3=NN=C(S3)NC(=O)C4CCCCC4

InChI

InChI=1S/C21H26N4O3S/c1-13-8-9-17(28-2)16(10-13)25-12-15(11-18(25)26)20-23-24-21(29-20)22-19(27)14-6-4-3-5-7-14/h8-10,14-15H,3-7,11-12H2,1-2H3,(H,22,24,27)/t15-/m1/s1