N-[1-[5-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide

Systemtic Name: N-[1-[5-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide Openeye Name: N-[1-[5-[2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide CAS Name: N-[1-[5-[[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-methylbenzamide IUPAC Name: N-[1-[5-[2-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-methylbenzamide Traditional Name: N-[1-[5-[[2-[(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-benzamide Formula: C24H26N6O2S2 MolecularWeight: 494.63224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C)C2=NN=C(N2C)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(C)C2=NN=C(N2C)SCC(=O)NC3=C(C4=C(S3)CCCC4)C#N

InChI

InChI=1S/C24H26N6O2S2/c1-14-8-4-5-9-16(14)22(32)26-15(2)21-28-29-24(30(21)3)33-13-20(31)27-23-18(12-25)17-10-6-7-11-19(17)34-23/h4-5,8-9,15H,6-7,10-11,13H2,1-3H3,(H,26,32)(H,27,31)