N-(2-azanyl-3-heptan-4-ylsulfonyl-propanoyl)-3-ethyl-benzamide

Systemtic Name: N-(2-azanyl-3-heptan-4-ylsulfonyl-propanoyl)-3-ethyl-benzamide Openeye Name: N-[2-amino-3-(1-propylbutylsulfonyl)propanoyl]-3-ethyl-benzamide CAS Name: N-(2-amino-3-heptan-4-ylsulfonyl-1-oxopropyl)-3-ethylbenzamide IUPAC Name: N-(2-amino-3-heptan-4-ylsulfonylpropanoyl)-3-ethylbenzamide Traditional Name: N-[2-amino-3-(1-propylbutylsulfonyl)propanoyl]-3-ethyl-benzamide Formula: C19H30N2O4S MolecularWeight: 382.5175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(=O)C1=CC(=CC=C1)CC)N

Isomeric SMILES

CCCC(CCC)S(=O)(=O)CC(C(=O)NC(=O)C1=CC(=CC=C1)CC)N

InChI

InChI=1S/C19H30N2O4S/c1-4-8-16(9-5-2)26(24,25)13-17(20)19(23)21-18(22)15-11-7-10-14(6-3)12-15/h7,10-12,16-17H,4-6,8-9,13,20H2,1-3H3,(H,21,22,23)