4-methoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-6-nitro-1,3-benzothiazol-2-amine

Systemtic Name: 4-methoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-6-nitro-1,3-benzothiazol-2-amine Openeye Name: 4-methoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-6-nitro-1,3-benzothiazol-2-amine CAS Name: 4-methoxy-N-[4-(methylthio)-1,3-benzothiazol-2-yl]-6-nitro-1,3-benzothiazol-2-amine IUPAC Name: 4-methoxy-N-(4-methylsulfanyl-1,3-benzothiazol-2-yl)-6-nitro-1,3-benzothiazol-2-amine Traditional Name: (4-methoxy-6-nitro-1,3-benzothiazol-2-yl)-[4-(methylthio)-1,3-benzothiazol-2-yl]amine Formula: C16H12N4O3S3 MolecularWeight: 404.48648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)NC3=NC4=C(S3)C=CC=C4SC

Isomeric SMILES

COC1=C2C(=CC(=C1)[N+](=O)[O-])SC(=N2)NC3=NC4=C(S3)C=CC=C4SC

InChI

InChI=1S/C16H12N4O3S3/c1-23-9-6-8(20(21)22)7-12-13(9)17-15(26-12)19-16-18-14-10(24-2)4-3-5-11(14)25-16/h3-7H,1-2H3,(H,17,18,19)