[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone

Systemtic Name: [4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Openeye Name: [4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-[3-(1-piperidylsulfonyl)-2-thienyl]methanone CAS Name: [4-[(4-methoxyphenyl)methyl]-1-piperazinyl]-[3-(1-piperidinylsulfonyl)-2-thiophenyl]methanone IUPAC Name: [4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Traditional Name: (4-p-anisylpiperazino)-(3-piperidinosulfonyl-2-thienyl)methanone Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H29N3O4S2/c1-29-19-7-5-18(6-8-19)17-23-12-14-24(15-13-23)22(26)21-20(9-16-30-21)31(27,28)25-10-3-2-4-11-25/h5-9,16H,2-4,10-15,17H2,1H3