2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[(4-isobutyl-5-methyl-1H-imidazol-2-yl)sulfanyl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]thio]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[[5-methyl-4-(2-methylpropyl)-1H-imidazol-2-yl]sulfanyl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[(4-isobutyl-5-methyl-1H-imidazol-2-yl)thio]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C17H19N5O3S2 MolecularWeight: 405.49446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])CC(C)C

Isomeric SMILES

CC1=C(N=C(N1)SCC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])CC(C)C

InChI

InChI=1S/C17H19N5O3S2/c1-9(2)6-13-10(3)18-16(20-13)26-8-15(23)21-17-19-12-5-4-11(22(24)25)7-14(12)27-17/h4-5,7,9H,6,8H2,1-3H3,(H,18,20)(H,19,21,23)