4-(4-chlorophenyl)sulfanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]butyramide Formula: C24H21ClN2OS2 MolecularWeight: 453.01934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCCSC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CCCSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H21ClN2OS2/c1-16-4-13-21-22(15-16)30-24(27-21)17-5-9-19(10-6-17)26-23(28)3-2-14-29-20-11-7-18(25)8-12-20/h4-13,15H,2-3,14H2,1H3,(H,26,28)