2-[(4-chlorophenyl)-phenyl-methyl]sulfanyl-6-nitro-1,3-benzothiazole

Systemtic Name: 2-[(4-chlorophenyl)-phenyl-methyl]sulfanyl-6-nitro-1,3-benzothiazole Openeye Name: 2-[(4-chlorophenyl)-phenyl-methyl]sulfanyl-6-nitro-1,3-benzothiazole CAS Name: 2-[[(4-chlorophenyl)-phenylmethyl]thio]-6-nitro-1,3-benzothiazole IUPAC Name: 2-[(4-chlorophenyl)-phenylmethyl]sulfanyl-6-nitro-1,3-benzothiazole Traditional Name: 2-[[(4-chlorophenyl)-phenyl-methyl]thio]-6-nitro-1,3-benzothiazole Formula: C20H13ClN2O2S2 MolecularWeight: 412.91242

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=C(C=C2)Cl)SC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H13ClN2O2S2/c21-15-8-6-14(7-9-15)19(13-4-2-1-3-5-13)27-20-22-17-11-10-16(23(24)25)12-18(17)26-20/h1-12,19H