N-cycloheptyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]ethanamide

Systemtic Name: N-cycloheptyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]ethanamide Openeye Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-cycloheptyl-acetamide CAS Name: N-cycloheptyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl-(phenylmethyl)amino]acetamide IUPAC Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-cycloheptylacetamide Traditional Name: 2-[benzyl-[(2-methyl-1,3-benzothiazol-6-yl)sulfonyl]amino]-N-cycloheptyl-acetamide Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC(=O)NC4CCCCCC4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC(=O)NC4CCCCCC4

InChI

InChI=1S/C24H29N3O3S2/c1-18-25-22-14-13-21(15-23(22)31-18)32(29,30)27(16-19-9-5-4-6-10-19)17-24(28)26-20-11-7-2-3-8-12-20/h4-6,9-10,13-15,20H,2-3,7-8,11-12,16-17H2,1H3,(H,26,28)