N-[3-methyl-4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-methyl-4-[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-methyl-4-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]phenyl]thiophene-2-carboxamide CAS Name: N-[3-methyl-4-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-methyl-4-[[2-[(4-methyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-methyl-4-[[2-[[4-methyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]phenyl]thiophene-2-carboxamide Formula: C21H19N5O2S3 MolecularWeight: 469.60286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC=CS2)NC(=O)CSC3=NN=C(N3C)C4=CC=CS4

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC=CS2)NC(=O)CSC3=NN=C(N3C)C4=CC=CS4

InChI

InChI=1S/C21H19N5O2S3/c1-13-11-14(22-20(28)17-6-4-10-30-17)7-8-15(13)23-18(27)12-31-21-25-24-19(26(21)2)16-5-3-9-29-16/h3-11H,12H2,1-2H3,(H,22,28)(H,23,27)