methyl 2-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamoylamino]thiophene-3-carboxylate CAS Name: 2-[[oxo-[4-(1-pyrrolidinylmethyl)anilino]methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(pyrrolidin-1-ylmethyl)phenyl]carbamoylamino]thiophene-3-carboxylate Traditional Name: 2-[[4-(pyrrolidinomethyl)phenyl]carbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)NC2=CC=C(C=C2)CN3CCCC3

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)NC2=CC=C(C=C2)CN3CCCC3

InChI

InChI=1S/C18H21N3O3S/c1-24-17(22)15-8-11-25-16(15)20-18(23)19-14-6-4-13(5-7-14)12-21-9-2-3-10-21/h4-8,11H,2-3,9-10,12H2,1H3,(H2,19,20,23)