ethyl 5-(2-indol-1-ylethanoylamino)-3-methyl-4-(phenylcarbamoyl)thiophene-2-carboxylate

Systemtic Name: ethyl 5-(2-indol-1-ylethanoylamino)-3-methyl-4-(phenylcarbamoyl)thiophene-2-carboxylate Openeye Name: ethyl 5-[(2-indol-1-ylacetyl)amino]-3-methyl-4-(phenylcarbamoyl)thiophene-2-carboxylate CAS Name: 4-[anilino(oxo)methyl]-5-[[2-(1-indolyl)-1-oxoethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2-indol-1-ylacetyl)amino]-3-methyl-4-(phenylcarbamoyl)thiophene-2-carboxylate Traditional Name: 5-[(2-indol-1-ylacetyl)amino]-3-methyl-4-(phenylcarbamoyl)thiophene-2-carboxylic acid ethyl ester Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CN2C=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CN2C=CC3=CC=CC=C32)C(=O)NC4=CC=CC=C4)C

InChI

InChI=1S/C25H23N3O4S/c1-3-32-25(31)22-16(2)21(23(30)26-18-10-5-4-6-11-18)24(33-22)27-20(29)15-28-14-13-17-9-7-8-12-19(17)28/h4-14H,3,15H2,1-2H3,(H,26,30)(H,27,29)