2-chloranyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(phenylmethyl)benzamide

Systemtic Name: 2-chloranyl-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-2-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide CAS Name: 2-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide Traditional Name: N-benzyl-2-chloro-N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitro-benzamide Formula: C23H18ClN3O3S MolecularWeight: 451.92532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C23H18ClN3O3S/c1-14-10-15(2)21-20(11-14)31-23(25-21)26(13-16-6-4-3-5-7-16)22(28)18-9-8-17(27(29)30)12-19(18)24/h3-12H,13H2,1-2H3