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

Systemtic Name: methyl 2-phenyl-2-[4-[4-[(2-thiophen-2-ylphenyl)carbonylamino]phenyl]piperazin-1-yl]ethanoate Openeye Name: methyl 2-phenyl-2-[4-[4-[[2-(2-thienyl)benzoyl]amino]phenyl]piperazin-1-yl]acetate CAS Name: 2-[4-[4-[[oxo-(2-thiophen-2-ylphenyl)methyl]amino]phenyl]-1-piperazinyl]-2-phenylacetic acid methyl ester IUPAC Name: methyl 2-phenyl-2-[4-[4-[(2-thiophen-2-ylbenzoyl)amino]phenyl]piperazin-1-yl]acetate Traditional Name: 2-phenyl-2-[4-[4-[[2-(2-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=CC=CS5

Isomeric SMILES

COC(=O)C(C1=CC=CC=C1)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=CS5

InChI

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