N-[3-oxidanylidene-3-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]propyl]thiophene-2-carboxamide

Systemtic Name: N-[3-oxidanylidene-3-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]propyl]thiophene-2-carboxamide Openeye Name: N-[3-oxo-3-(4-tetralin-6-ylsulfonylpiperazin-1-yl)propyl]thiophene-2-carboxamide CAS Name: N-[3-oxo-3-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]propyl]-2-thiophenecarboxamide IUPAC Name: N-[3-oxo-3-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]propyl]thiophene-2-carboxamide Traditional Name: N-[3-keto-3-(4-tetralin-6-ylsulfonylpiperazino)propyl]thiophene-2-carboxamide Formula: C22H27N3O4S2 MolecularWeight: 461.59748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCNC(=O)C4=CC=CS4

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)S(=O)(=O)N3CCN(CC3)C(=O)CCNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H27N3O4S2/c26-21(9-10-23-22(27)20-6-3-15-30-20)24-11-13-25(14-12-24)31(28,29)19-8-7-17-4-1-2-5-18(17)16-19/h3,6-8,15-16H,1-2,4-5,9-14H2,(H,23,27)