3-[(3,4-dimethylphenyl)amino]-2-[4-(6-nitro-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile

Systemtic Name: 3-[(3,4-dimethylphenyl)amino]-2-[4-(6-nitro-2-oxidanylidene-chromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: 3-(3,4-dimethylanilino)-2-[4-(6-nitro-2-oxo-chromen-3-yl)thiazol-2-yl]prop-2-enenitrile CAS Name: 3-(3,4-dimethylanilino)-2-[4-(6-nitro-2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-2-propenenitrile IUPAC Name: 3-(3,4-dimethylanilino)-2-[4-(6-nitro-2-oxochromen-3-yl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: 3-(3,4-dimethylanilino)-2-[4-(2-keto-6-nitro-chromen-3-yl)thiazol-2-yl]acrylonitrile Formula: C23H16N4O4S MolecularWeight: 444.46254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC4=C(C=CC(=C4)[N+](=O)[O-])OC3=O)C

InChI

InChI=1S/C23H16N4O4S/c1-13-3-4-17(7-14(13)2)25-11-16(10-24)22-26-20(12-32-22)19-9-15-8-18(27(29)30)5-6-21(15)31-23(19)28/h3-9,11-12,25H,1-2H3