methyl 3-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]thiophene-2-carboxylate CAS Name: 3-[[[[1-[(4-chlorophenyl)methyl]-2-pyrrolyl]methylamino]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[1-[(4-chlorophenyl)methyl]pyrrol-2-yl]methylcarbamoylamino]thiophene-2-carboxylate Traditional Name: 3-[[1-(4-chlorobenzyl)pyrrol-2-yl]methylcarbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)NCC2=CC=CN2CC3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)NCC2=CC=CN2CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18ClN3O3S/c1-26-18(24)17-16(8-10-27-17)22-19(25)21-11-15-3-2-9-23(15)12-13-4-6-14(20)7-5-13/h2-10H,11-12H2,1H3,(H2,21,22,25)