[2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 5-(cyclopropylcarbonylamino)-3-methyl-thiophene-2-carboxylate

Systemtic Name: [2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxidanylidene-ethyl] 5-(cyclopropylcarbonylamino)-3-methyl-thiophene-2-carboxylate Openeye Name: [2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-oxo-ethyl] 5-(cyclopropanecarbonylamino)-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[cyclopropyl(oxo)methyl]amino]-3-methyl-2-thiophenecarboxylic acid [2-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-2-oxoethyl] ester IUPAC Name: [2-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl] 5-(cyclopropanecarbonylamino)-3-methylthiophene-2-carboxylate Traditional Name: 5-(cyclopropanecarbonylamino)-3-methyl-thiophene-2-carboxylic acid [2-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-2-keto-ethyl] ester Formula: C21H24N2O4S MolecularWeight: 400.49126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)COC(=O)C3=C(C=C(S3)NC(=O)C4CC4)C

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)COC(=O)C3=C(C=C(S3)NC(=O)C4CC4)C

InChI

InChI=1S/C21H24N2O4S/c1-11-8-18(22-20(25)14-4-5-14)28-19(11)21(26)27-10-17(24)16-9-12(2)23(13(16)3)15-6-7-15/h8-9,14-15H,4-7,10H2,1-3H3,(H,22,25)