4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-(4-tetralin-6-ylsulfonylpiperazine-1-carbonyl)benzonitrile CAS Name: 4-[oxo-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbonyl]benzonitrile Traditional Name: 4-(4-tetralin-6-ylsulfonylpiperazine-1-carbonyl)benzonitrile Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S/c23-16-17-5-7-19(8-6-17)22(26)24-11-13-25(14-12-24)29(27,28)21-10-9-18-3-1-2-4-20(18)15-21/h5-10,15H,1-4,11-14H2