(2R)-2-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]amino]-N,N-dimethyl-2-phenyl-ethanamide

Systemtic Name: (2R)-2-[[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]amino]-N,N-dimethyl-2-phenyl-ethanamide Openeye Name: (2R)-2-[3-(azepan-1-ylsulfonyl)-4-methyl-anilino]-N,N-dimethyl-2-phenyl-acetamide CAS Name: (2R)-2-[3-(1-azepanylsulfonyl)-4-methylanilino]-N,N-dimethyl-2-phenylacetamide IUPAC Name: (2R)-2-[3-(azepan-1-ylsulfonyl)-4-methylanilino]-N,N-dimethyl-2-phenylacetamide Traditional Name: (2R)-2-[3-(azepan-1-ylsulfonyl)-4-methyl-anilino]-N,N-dimethyl-2-phenyl-acetamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(C2=CC=CC=C2)C(=O)N(C)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)N[C@H](C2=CC=CC=C2)C(=O)N(C)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H31N3O3S/c1-18-13-14-20(17-21(18)30(28,29)26-15-9-4-5-10-16-26)24-22(23(27)25(2)3)19-11-7-6-8-12-19/h6-8,11-14,17,22,24H,4-5,9-10,15-16H2,1-3H3/t22-/m1/s1