methyl 5-tert-butyl-3-[(1-methylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 5-tert-butyl-3-[(1-methylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[(1-methylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylate CAS Name: 5-tert-butyl-3-[[[(1-methyl-3-pyrrolyl)amino]-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[(1-methylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylate Traditional Name: 5-tert-butyl-3-[(1-methylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NC(=O)NC2=CN(C=C2)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(S1)C(=O)OC)NC(=O)NC2=CN(C=C2)C

InChI

InChI=1S/C16H21N3O3S/c1-16(2,3)12-8-11(13(23-12)14(20)22-5)18-15(21)17-10-6-7-19(4)9-10/h6-9H,1-5H3,(H2,17,18,21)