4-[(5-chloranylthiophen-2-yl)methyl]-1-(3-methoxyphenyl)carbonyl-N-(phenylmethyl)piperazine-2-carboxamide

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methyl]-1-(3-methoxyphenyl)carbonyl-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-4-[(5-chloro-2-thienyl)methyl]-1-(3-methoxybenzoyl)piperazine-2-carboxamide CAS Name: 4-[(5-chloro-2-thiophenyl)methyl]-1-[(3-methoxyphenyl)-oxomethyl]-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-4-[(5-chlorothiophen-2-yl)methyl]-1-(3-methoxybenzoyl)piperazine-2-carboxamide Traditional Name: N-benzyl-4-[(5-chloro-2-thienyl)methyl]-1-m-anisoyl-piperazine-2-carboxamide Formula: C25H26ClN3O3S MolecularWeight: 484.01024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)N2CCN(CC2C(=O)NCC3=CC=CC=C3)CC4=CC=C(S4)Cl

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)N2CCN(CC2C(=O)NCC3=CC=CC=C3)CC4=CC=C(S4)Cl

InChI

InChI=1S/C25H26ClN3O3S/c1-32-20-9-5-8-19(14-20)25(31)29-13-12-28(16-21-10-11-23(26)33-21)17-22(29)24(30)27-15-18-6-3-2-4-7-18/h2-11,14,22H,12-13,15-17H2,1H3,(H,27,30)