4-(azepan-1-ylsulfonyl)-N,N-diphenethyl-benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N,N-diphenethyl-benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N,N-diphenethyl-benzamide CAS Name: 4-(1-azepanylsulfonyl)-N,N-diphenethylbenzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N,N-diphenethylbenzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N,N-diphenethyl-benzamide Formula: C29H34N2O3S MolecularWeight: 490.65686

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCC3=CC=CC=C3)CCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCC3=CC=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C29H34N2O3S/c32-29(27-15-17-28(18-16-27)35(33,34)31-21-9-1-2-10-22-31)30(23-19-25-11-5-3-6-12-25)24-20-26-13-7-4-8-14-26/h3-8,11-18H,1-2,9-10,19-24H2