3-(azepan-1-ylsulfonyl)-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(4-methylthiazol-2-yl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-(4-methyl-2-thiazolyl)benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(4-methyl-1,3-thiazol-2-yl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(4-methylthiazol-2-yl)benzamide Formula: C18H23N3O4S2 MolecularWeight: 409.52292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C18H23N3O4S2/c1-13-12-26-18(19-13)20-17(22)14-7-8-15(25-2)16(11-14)27(23,24)21-9-5-3-4-6-10-21/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,19,20,22)