N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[4-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-3-pyrrolidin-1-ylcarbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-carboxamide CAS Name: N-[4-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[4-[4-(4-methylbenzoyl)piperazin-1-yl]-3-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-carboxamide Traditional Name: N-[4-(4-p-toluoylpiperazino)-3-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-carboxamide Formula: C28H30N4O3S MolecularWeight: 502.6278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CS4)C(=O)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CS4)C(=O)N5CCCC5

InChI

InChI=1S/C28H30N4O3S/c1-20-6-8-21(9-7-20)27(34)32-16-14-30(15-17-32)24-11-10-22(29-26(33)25-5-4-18-36-25)19-23(24)28(35)31-12-2-3-13-31/h4-11,18-19H,2-3,12-17H2,1H3,(H,29,33)