4-(4-methoxyphenyl)sulfanyl-N-(3,5,7-trimethyl-1,3-benzothiazol-2-ylidene)butanamide

Systemtic Name: 4-(4-methoxyphenyl)sulfanyl-N-(3,5,7-trimethyl-1,3-benzothiazol-2-ylidene)butanamide Openeye Name: 4-(4-methoxyphenyl)sulfanyl-N-(3,5,7-trimethyl-1,3-benzothiazol-2-ylidene)butanamide CAS Name: 4-[(4-methoxyphenyl)thio]-N-(3,5,7-trimethyl-1,3-benzothiazol-2-ylidene)butanamide IUPAC Name: 4-(4-methoxyphenyl)sulfanyl-N-(3,5,7-trimethyl-1,3-benzothiazol-2-ylidene)butanamide Traditional Name: 4-[(4-methoxyphenyl)thio]-N-(3,5,7-trimethyl-1,3-benzothiazol-2-ylidene)butyramide Formula: C21H24N2O2S2 MolecularWeight: 400.55746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N(C(=NC(=O)CCCSC3=CC=C(C=C3)OC)S2)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N(C(=NC(=O)CCCSC3=CC=C(C=C3)OC)S2)C)C

InChI

InChI=1S/C21H24N2O2S2/c1-14-12-15(2)20-18(13-14)23(3)21(27-20)22-19(24)6-5-11-26-17-9-7-16(25-4)8-10-17/h7-10,12-13H,5-6,11H2,1-4H3