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

Systemtic Name: 4-[(5-chloranylthiophen-2-yl)methyl]-1-methylsulfonyl-N-(phenylmethyl)piperazine-2-carboxamide Openeye Name: N-benzyl-4-[(5-chloro-2-thienyl)methyl]-1-methylsulfonyl-piperazine-2-carboxamide CAS Name: 4-[(5-chloro-2-thiophenyl)methyl]-1-methylsulfonyl-N-(phenylmethyl)-2-piperazinecarboxamide IUPAC Name: N-benzyl-4-[(5-chlorothiophen-2-yl)methyl]-1-methylsulfonylpiperazine-2-carboxamide Traditional Name: N-benzyl-4-[(5-chloro-2-thienyl)methyl]-1-mesyl-piperazine-2-carboxamide Formula: C18H22ClN3O3S2 MolecularWeight: 427.96858

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1C(=O)NCC2=CC=CC=C2)CC3=CC=C(S3)Cl

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1C(=O)NCC2=CC=CC=C2)CC3=CC=C(S3)Cl

InChI

InChI=1S/C18H22ClN3O3S2/c1-27(24,25)22-10-9-21(12-15-7-8-17(19)26-15)13-16(22)18(23)20-11-14-5-3-2-4-6-14/h2-8,16H,9-13H2,1H3,(H,20,23)