2-[4-(1,2,3,4-tetrahydronaphthalen-1-ylcarbonyl)piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(1,2,3,4-tetrahydronaphthalen-1-ylcarbonyl)piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-(tetralin-1-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[oxo(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(1,2,3,4-tetrahydronaphthalene-1-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(tetralin-1-carbonyl)piperazino]sulfonylbenzonitrile Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=CC=CC=C2C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CC(C2=CC=CC=C2C1)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C22H23N3O3S/c23-16-18-7-2-4-11-21(18)29(27,28)25-14-12-24(13-15-25)22(26)20-10-5-8-17-6-1-3-9-19(17)20/h1-4,6-7,9,11,20H,5,8,10,12-15H2