methyl 2-phenyl-2-[4-[4-[(2-thiophen-3-ylphenyl)carbonylamino]phenyl]piperazin-1-yl]ethanoate

Systemtic Name: methyl 2-phenyl-2-[4-[4-[(2-thiophen-3-ylphenyl)carbonylamino]phenyl]piperazin-1-yl]ethanoate Openeye Name: methyl 2-phenyl-2-[4-[4-[[2-(3-thienyl)benzoyl]amino]phenyl]piperazin-1-yl]acetate CAS Name: 2-[4-[4-[[oxo-[2-(3-thiophenyl)phenyl]methyl]amino]phenyl]-1-piperazinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-phenyl-2-[4-[4-[(2-thiophen-3-ylbenzoyl)amino]phenyl]piperazin-1-yl]acetate Traditional Name: 2-phenyl-2-[4-[4-[[2-(3-thienyl)benzoyl]amino]phenyl]piperazino]acetic acid methyl ester Formula: C30H29N3O3S MolecularWeight: 511.63456

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CSC=C5

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CSC=C5

InChI

InChI=1S/C30H29N3O3S/c1-36-30(35)28(22-7-3-2-4-8-22)33-18-16-32(17-19-33)25-13-11-24(12-14-25)31-29(34)27-10-6-5-9-26(27)23-15-20-37-21-23/h2-15,20-21,28H,16-19H2,1H3,(H,31,34)