[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-tetralin-1-yl-methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-(1,2,3,4-tetrahydronaphthalen-1-yl)methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-tetralin-1-yl-methanone Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCCC4=CC=CC=C34

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)N2CCN(CC2)C(=O)C3CCCC4=CC=CC=C34

InChI

InChI=1S/C21H31N3O3S/c25-21(20-11-7-9-18-8-3-4-10-19(18)20)22-14-16-24(17-15-22)28(26,27)23-12-5-1-2-6-13-23/h3-4,8,10,20H,1-2,5-7,9,11-17H2