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

Systemtic Name: methyl 5-tert-butyl-3-[(1-propylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylate Openeye Name: methyl 5-tert-butyl-3-[(1-propylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylate CAS Name: 5-tert-butyl-3-[[oxo-[(1-propyl-3-pyrrolyl)amino]methyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-tert-butyl-3-[(1-propylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylate Traditional Name: 5-tert-butyl-3-[(1-propylpyrrol-3-yl)carbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C18H25N3O3S MolecularWeight: 363.4744

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CC(=C1)NC(=O)NC2=C(SC(=C2)C(C)(C)C)C(=O)OC

Isomeric SMILES

CCCN1C=CC(=C1)NC(=O)NC2=C(SC(=C2)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C18H25N3O3S/c1-6-8-21-9-7-12(11-21)19-17(23)20-13-10-14(18(2,3)4)25-15(13)16(22)24-5/h7,9-11H,6,8H2,1-5H3,(H2,19,20,23)