1-[4-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[(2-methyl-1,3-benzothiazol-6-yl)amino]-3-nitro-phenyl]ethanone Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)NC3=C(C=C(C=C3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)NC3=C(C=C(C=C3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O3S/c1-9(20)11-3-5-13(15(7-11)19(21)22)18-12-4-6-14-16(8-12)23-10(2)17-14/h3-8,18H,1-2H3