4-(azepan-1-ylsulfonyl)-N,N-bis(2-cyanoethyl)benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N,N-bis(2-cyanoethyl)benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N,N-bis(2-cyanoethyl)benzamide CAS Name: 4-(1-azepanylsulfonyl)-N,N-bis(2-cyanoethyl)benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N,N-bis(2-cyanoethyl)benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N,N-bis(2-cyanoethyl)benzamide Formula: C19H24N4O3S MolecularWeight: 388.48386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCC#N)CCC#N

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCC#N)CCC#N

InChI

InChI=1S/C19H24N4O3S/c20-11-5-13-22(14-6-12-21)19(24)17-7-9-18(10-8-17)27(25,26)23-15-3-1-2-4-16-23/h7-10H,1-6,13-16H2