(2R)-2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-methyl-propanamide

Systemtic Name: (2R)-2-[[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]amino]-N-methyl-propanamide Openeye Name: (2R)-2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-methyl-propanamide CAS Name: (2R)-2-[5-(1-azepanylsulfonyl)-2-methoxyanilino]-N-methylpropanamide IUPAC Name: (2R)-2-[5-(azepan-1-ylsulfonyl)-2-methoxyanilino]-N-methylpropanamide Traditional Name: (2R)-2-[5-(azepan-1-ylsulfonyl)-2-methoxy-anilino]-N-methyl-propionamide Formula: C17H27N3O4S MolecularWeight: 369.47898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC

Isomeric SMILES

C[C@H](C(=O)NC)NC1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC

InChI

InChI=1S/C17H27N3O4S/c1-13(17(21)18-2)19-15-12-14(8-9-16(15)24-3)25(22,23)20-10-6-4-5-7-11-20/h8-9,12-13,19H,4-7,10-11H2,1-3H3,(H,18,21)/t13-/m1/s1