N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-5-nitro-benzamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-5-nitro-benzamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-2-(4-methylthiazol-2-yl)sulfanyl-5-nitro-benzamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-2-[(4-methyl-2-thiazolyl)thio]-5-nitrobenzamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-5-nitrobenzamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-2-[(4-methylthiazol-2-yl)thio]-5-nitro-benzamide Formula: C22H14N4O3S3 MolecularWeight: 478.56656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C22H14N4O3S3/c1-12-11-30-22(23-12)32-17-9-7-14(26(28)29)10-16(17)20(27)25-21-24-19-15-5-3-2-4-13(15)6-8-18(19)31-21/h2-11H,1H3,(H,24,25,27)