4-ethylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)benzamide

Systemtic Name: 4-ethylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-4-ethylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 4-(ethylthio)-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-4-ethylsulfanyl-N-(4-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: N-benzyl-4-(ethylthio)-N-(4-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C24H22N2O3S3 MolecularWeight: 482.63808

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=CC=C4S(=O)(=O)C

InChI

InChI=1S/C24H22N2O3S3/c1-3-30-19-14-12-18(13-15-19)23(27)26(16-17-8-5-4-6-9-17)24-25-22-20(31-24)10-7-11-21(22)32(2,28)29/h4-15H,3,16H2,1-2H3