4-(2,4-dimethylphenoxy)-N-(2-sulfanylidene-3H-1,3-benzothiazol-5-yl)butanamide

Systemtic Name: 4-(2,4-dimethylphenoxy)-N-(2-sulfanylidene-3H-1,3-benzothiazol-5-yl)butanamide Openeye Name: 4-(2,4-dimethylphenoxy)-N-(2-thioxo-3H-1,3-benzothiazol-5-yl)butanamide CAS Name: 4-(2,4-dimethylphenoxy)-N-(2-sulfanylidene-3H-1,3-benzothiazol-5-yl)butanamide IUPAC Name: 4-(2,4-dimethylphenoxy)-N-(2-sulfanylidene-3H-1,3-benzothiazol-5-yl)butanamide Traditional Name: 4-(2,4-dimethylphenoxy)-N-(2-thioxo-3H-1,3-benzothiazol-5-yl)butyramide Formula: C19H20N2O2S2 MolecularWeight: 372.5043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCCC(=O)NC2=CC3=C(C=C2)SC(=S)N3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCCC(=O)NC2=CC3=C(C=C2)SC(=S)N3)C

InChI

InChI=1S/C19H20N2O2S2/c1-12-5-7-16(13(2)10-12)23-9-3-4-18(22)20-14-6-8-17-15(11-14)21-19(24)25-17/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,22)(H,21,24)