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

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-[(4-nitrophenyl)amino]prop-2-enenitrile Openeye Name: 2-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-(4-nitroanilino)prop-2-enenitrile CAS Name: 2-[4-(3,4-dimethoxyphenyl)-2-thiazolyl]-3-(4-nitroanilino)-2-propenenitrile IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-3-(4-nitroanilino)prop-2-enenitrile Traditional Name: 2-[4-(3,4-dimethoxyphenyl)thiazol-2-yl]-3-(4-nitroanilino)acrylonitrile Formula: C20H16N4O4S MolecularWeight: 408.43044

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=C(C=C3)[N+](=O)[O-])C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=C(C=C3)[N+](=O)[O-])C#N)OC

InChI

InChI=1S/C20H16N4O4S/c1-27-18-8-3-13(9-19(18)28-2)17-12-29-20(23-17)14(10-21)11-22-15-4-6-16(7-5-15)24(25)26/h3-9,11-12,22H,1-2H3