N-(5-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(5-chloranyl-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(5-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(5-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(5-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(5-chloro-3,4-dimethyl-1,3-benzothiazol-2-ylidene)-4-[(4-methoxyphenyl)thio]butyramide Formula: C20H21ClN2O2S2 MolecularWeight: 420.97594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1N(C(=NC(=O)CCCSC3=CC=C(C=C3)OC)S2)C)Cl

Isomeric SMILES

CC1=C(C=CC2=C1N(C(=NC(=O)CCCSC3=CC=C(C=C3)OC)S2)C)Cl

InChI

InChI=1S/C20H21ClN2O2S2/c1-13-16(21)10-11-17-19(13)23(2)20(27-17)22-18(24)5-4-12-26-15-8-6-14(25-3)7-9-15/h6-11H,4-5,12H2,1-3H3