N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-(5-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(5-chloro-4-methyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C17H14ClN3O5S MolecularWeight: 407.82816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N=C(S2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N=C(S2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC)Cl

InChI

InChI=1S/C17H14ClN3O5S/c1-8-10(18)4-5-14-15(8)19-17(27-14)20-16(22)9-6-12(25-2)13(26-3)7-11(9)21(23)24/h4-7H,1-3H3,(H,19,20,22)