propan-2-yl 4-cyano-5-[3-[3-[(3-cyano-4-methyl-5-propan-2-yloxycarbonyl-thiophen-2-yl)amino]-3-oxidanylidene-propyl]sulfanylpropanoylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: propan-2-yl 4-cyano-5-[3-[3-[(3-cyano-4-methyl-5-propan-2-yloxycarbonyl-thiophen-2-yl)amino]-3-oxidanylidene-propyl]sulfanylpropanoylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: isopropyl 4-cyano-5-[3-[3-[(3-cyano-5-isopropoxycarbonyl-4-methyl-2-thienyl)amino]-3-oxo-propyl]sulfanylpropanoylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 4-cyano-5-[[3-[[3-[[3-cyano-4-methyl-5-[oxo(propan-2-yloxy)methyl]-2-thiophenyl]amino]-3-oxopropyl]thio]-1-oxopropyl]amino]-3-methyl-2-thiophenecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-cyano-5-[3-[3-[(3-cyano-4-methyl-5-propan-2-yloxycarbonylthiophen-2-yl)amino]-3-oxopropyl]sulfanylpropanoylamino]-3-methylthiophene-2-carboxylate Traditional Name: 4-cyano-5-[3-[[3-[(3-cyano-5-isopropoxycarbonyl-4-methyl-2-thienyl)amino]-3-keto-propyl]thio]propanoylamino]-3-methyl-thiophene-2-carboxylic acid isopropyl ester Formula: C26H30N4O6S3 MolecularWeight: 590.7346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CCSCCC(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C#N)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CCSCCC(=O)NC2=C(C(=C(S2)C(=O)OC(C)C)C)C#N)C(=O)OC(C)C

InChI

InChI=1S/C26H30N4O6S3/c1-13(2)35-25(33)21-15(5)17(11-27)23(38-21)29-19(31)7-9-37-10-8-20(32)30-24-18(12-28)16(6)22(39-24)26(34)36-14(3)4/h13-14H,7-10H2,1-6H3,(H,29,31)(H,30,32)