3-methyl-N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)benzamide

Systemtic Name: 3-methyl-N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)benzamide Openeye Name: 3-methyl-N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)benzamide CAS Name: 3-methyl-N-[2-(phenacylthio)-1,3-benzothiazol-6-yl]benzamide IUPAC Name: 3-methyl-N-(2-phenacylsulfanyl-1,3-benzothiazol-6-yl)benzamide Traditional Name: 3-methyl-N-[2-(phenacylthio)-1,3-benzothiazol-6-yl]benzamide Formula: C23H18N2O2S2 MolecularWeight: 418.53122

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H18N2O2S2/c1-15-6-5-9-17(12-15)22(27)24-18-10-11-19-21(13-18)29-23(25-19)28-14-20(26)16-7-3-2-4-8-16/h2-13H,14H2,1H3,(H,24,27)