ethyl (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-3-oxidanylidene-3-(thiophen-2-ylamino)propanoate

Systemtic Name: ethyl (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-3-oxidanylidene-3-(thiophen-2-ylamino)propanoate Openeye Name: ethyl (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-3-oxo-3-(2-thienylamino)propanoate CAS Name: (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-3-oxo-3-(thiophen-2-ylamino)propanoic acid ethyl ester IUPAC Name: ethyl (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-3-oxo-3-(thiophen-2-ylamino)propanoate Traditional Name: (2Z)-2-(3,3-dimethyl-2,4-dihydroisoquinolin-1-ylidene)-3-keto-3-(2-thienylamino)propionic acid ethyl ester Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C2=CC=CC=C2CC(N1)(C)C)C(=O)NC3=CC=CS3

Isomeric SMILES

CCOC(=O)/C(=C\1/C2=CC=CC=C2CC(N1)(C)C)/C(=O)NC3=CC=CS3

InChI

InChI=1S/C20H22N2O3S/c1-4-25-19(24)16(18(23)21-15-10-7-11-26-15)17-14-9-6-5-8-13(14)12-20(2,3)22-17/h5-11,22H,4,12H2,1-3H3,(H,21,23)/b17-16-