2-[4-[4-oxidanylidene-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[4-oxidanylidene-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(4-oxo-4-tetralin-6-yl-butanoyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[1,4-dioxo-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[4-oxo-4-(5,6,7,8-tetrahydronaphthalen-2-yl)butanoyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(4-keto-4-tetralin-6-yl-butanoyl)piperazino]sulfonylbenzonitrile Formula: C25H27N3O4S MolecularWeight: 465.56458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=CC(=C2)C(=O)CCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CCC2=C(C1)C=CC(=C2)C(=O)CCC(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C25H27N3O4S/c26-18-22-7-3-4-8-24(22)33(31,32)28-15-13-27(14-16-28)25(30)12-11-23(29)21-10-9-19-5-1-2-6-20(19)17-21/h3-4,7-10,17H,1-2,5-6,11-16H2