2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-oxidanylidenechromen-6-yl)amino]prop-2-enenitrile

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-oxidanylidenechromen-6-yl)amino]prop-2-enenitrile Openeye Name: 2-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-[(2-oxochromen-6-yl)amino]prop-2-enenitrile CAS Name: 2-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-[(2-oxo-1-benzopyran-6-yl)amino]-2-propenenitrile IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-oxochromen-6-yl)amino]prop-2-enenitrile Traditional Name: 2-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-[(2-ketochromen-6-yl)amino]acrylonitrile Formula: C23H17N3O4S MolecularWeight: 431.46378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)C(=CNC3=CC4=C(C=C3)OC(=O)C=C4)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)C(=CNC3=CC4=C(C=C3)OC(=O)C=C4)C#N)OC

InChI

InChI=1S/C23H17N3O4S/c1-28-20-6-3-14(10-21(20)29-2)18-13-31-23(26-18)16(11-24)12-25-17-5-7-19-15(9-17)4-8-22(27)30-19/h3-10,12-13,25H,1-2H3