propan-2-yl 3-(1,3-benzothiazol-2-ylamino)-2-(1,3-dithiol-2-ylidene)-3-oxidanylidene-propanoate

Systemtic Name: propan-2-yl 3-(1,3-benzothiazol-2-ylamino)-2-(1,3-dithiol-2-ylidene)-3-oxidanylidene-propanoate Openeye Name: isopropyl 3-(1,3-benzothiazol-2-ylamino)-2-(1,3-dithiol-2-ylidene)-3-oxo-propanoate CAS Name: 3-(1,3-benzothiazol-2-ylamino)-2-(1,3-dithiol-2-ylidene)-3-oxopropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(1,3-benzothiazol-2-ylamino)-2-(1,3-dithiol-2-ylidene)-3-oxopropanoate Traditional Name: 3-(1,3-benzothiazol-2-ylamino)-2-(1,3-dithiol-2-ylidene)-3-keto-propionic acid isopropyl ester Formula: C16H14N2O3S3 MolecularWeight: 378.48896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(=C1SC=CS1)C(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)OC(=O)C(=C1SC=CS1)C(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H14N2O3S3/c1-9(2)21-14(20)12(15-22-7-8-23-15)13(19)18-16-17-10-5-3-4-6-11(10)24-16/h3-9H,1-2H3,(H,17,18,19)