N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-(7-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furylmethyl)acetamide CAS Name: N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furanylmethyl)-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-(benzylthio)-N-(7-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-furfuryl)acetamide Formula: C22H19ClN2O2S2 MolecularWeight: 442.98146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CO3)C(=O)CSCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=C(C=C1)Cl)SC(=N2)N(CC3=CC=CO3)C(=O)CSCC4=CC=CC=C4

InChI

InChI=1S/C22H19ClN2O2S2/c1-15-9-10-18(23)21-20(15)24-22(29-21)25(12-17-8-5-11-27-17)19(26)14-28-13-16-6-3-2-4-7-16/h2-11H,12-14H2,1H3