2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-methyl-N-(phenylmethyl)propanamide

Systemtic Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-methyl-N-(phenylmethyl)propanamide Openeye Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-benzyl-N-methyl-propanamide CAS Name: 2-[5-(1-azepanylsulfonyl)-1-indolyl]-N-methyl-N-(phenylmethyl)propanamide IUPAC Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-benzyl-N-methylpropanamide Traditional Name: 2-[5-(azepan-1-ylsulfonyl)indol-1-yl]-N-benzyl-N-methyl-propionamide Formula: C25H31N3O3S MolecularWeight: 453.59694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)CC1=CC=CC=C1)N2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC(C(=O)N(C)CC1=CC=CC=C1)N2C=CC3=C2C=CC(=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H31N3O3S/c1-20(25(29)26(2)19-21-10-6-5-7-11-21)28-17-14-22-18-23(12-13-24(22)28)32(30,31)27-15-8-3-4-9-16-27/h5-7,10-14,17-18,20H,3-4,8-9,15-16,19H2,1-2H3