N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2H-thiochromene-3-carboxamide

Systemtic Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2H-thiochromene-3-carboxamide Openeye Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2H-thiochromene-3-carboxamide CAS Name: N-[4-[4-(2-methoxyphenyl)-1-piperazinyl]butyl]-2H-1-benzothiopyran-3-carboxamide IUPAC Name: N-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]-2H-thiochromene-3-carboxamide Traditional Name: N-[4-[4-(2-methoxyphenyl)piperazino]butyl]-2H-thiochromene-3-carboxamide Formula: C25H31N3O2S MolecularWeight: 437.59754

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCCCNC(=O)C3=CC4=CC=CC=C4SC3

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCCCNC(=O)C3=CC4=CC=CC=C4SC3

InChI

InChI=1S/C25H31N3O2S/c1-30-23-10-4-3-9-22(23)28-16-14-27(15-17-28)13-7-6-12-26-25(29)21-18-20-8-2-5-11-24(20)31-19-21/h2-5,8-11,18H,6-7,12-17,19H2,1H3,(H,26,29)