4-cyano-5-[2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanylethanoylamino]-3-methyl-N-phenyl-thiophene-2-carboxamide

Systemtic Name: 4-cyano-5-[2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanylethanoylamino]-3-methyl-N-phenyl-thiophene-2-carboxamide Openeye Name: 4-cyano-5-[[2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanylacetyl]amino]-3-methyl-N-phenyl-thiophene-2-carboxamide CAS Name: 4-cyano-5-[[2-[[3-[[(2-methoxyanilino)-sulfanylidenemethyl]amino]phenyl]thio]-1-oxoethyl]amino]-3-methyl-N-phenyl-2-thiophenecarboxamide IUPAC Name: 4-cyano-5-[[2-[3-[(2-methoxyphenyl)carbamothioylamino]phenyl]sulfanylacetyl]amino]-3-methyl-N-phenylthiophene-2-carboxamide Traditional Name: 4-cyano-5-[[2-[[3-[(2-methoxyphenyl)thiocarbamoylamino]phenyl]thio]acetyl]amino]-3-methyl-N-phenyl-thiophene-2-carboxamide Formula: C29H25N5O3S3 MolecularWeight: 587.7355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CSC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3OC)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CSC2=CC=CC(=C2)NC(=S)NC3=CC=CC=C3OC)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C29H25N5O3S3/c1-18-22(16-30)28(40-26(18)27(36)31-19-9-4-3-5-10-19)34-25(35)17-39-21-12-8-11-20(15-21)32-29(38)33-23-13-6-7-14-24(23)37-2/h3-15H,17H2,1-2H3,(H,31,36)(H,34,35)(H2,32,33,38)