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

Systemtic Name: 2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-[(2-oxidanylidenechromen-6-yl)amino]prop-2-enenitrile Openeye Name: 2-[4-(3-nitrophenyl)thiazol-2-yl]-3-[(2-oxochromen-6-yl)amino]prop-2-enenitrile CAS Name: 2-[4-(3-nitrophenyl)-2-thiazolyl]-3-[(2-oxo-1-benzopyran-6-yl)amino]-2-propenenitrile IUPAC Name: 2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-[(2-oxochromen-6-yl)amino]prop-2-enenitrile Traditional Name: 3-[(2-ketochromen-6-yl)amino]-2-[4-(3-nitrophenyl)thiazol-2-yl]acrylonitrile Formula: C21H12N4O4S MolecularWeight: 416.40938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)C(=CNC3=CC4=C(C=C3)OC(=O)C=C4)C#N

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)C(=CNC3=CC4=C(C=C3)OC(=O)C=C4)C#N

InChI

InChI=1S/C21H12N4O4S/c22-10-15(11-23-16-5-6-19-14(8-16)4-7-20(26)29-19)21-24-18(12-30-21)13-2-1-3-17(9-13)25(27)28/h1-9,11-12,23H