3-methyl-N-[2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide

Systemtic Name: 3-methyl-N-[2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Openeye Name: 3-methyl-N-[2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide CAS Name: 3-methyl-N-[2-[[2-oxo-2-(4-phenylphenyl)ethyl]thio]-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3-methyl-N-[2-[2-oxo-2-(4-phenylphenyl)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide Traditional Name: N-[2-[[2-keto-2-(4-phenylphenyl)ethyl]thio]-1,3-benzothiazol-6-yl]-3-methyl-benzamide Formula: C29H22N2O2S2 MolecularWeight: 494.62718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H22N2O2S2/c1-19-6-5-9-23(16-19)28(33)30-24-14-15-25-27(17-24)35-29(31-25)34-18-26(32)22-12-10-21(11-13-22)20-7-3-2-4-8-20/h2-17H,18H2,1H3,(H,30,33)