3-[(3,5-dimethylphenyl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile

Systemtic Name: 3-[(3,5-dimethylphenyl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: 3-(3,5-dimethylanilino)-2-[4-(4-nitrophenyl)thiazol-2-yl]prop-2-enenitrile CAS Name: 3-(3,5-dimethylanilino)-2-[4-(4-nitrophenyl)-2-thiazolyl]-2-propenenitrile IUPAC Name: 3-(3,5-dimethylanilino)-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: 3-(3,5-dimethylanilino)-2-[4-(4-nitrophenyl)thiazol-2-yl]acrylonitrile Formula: C20H16N4O2S MolecularWeight: 376.43164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N4O2S/c1-13-7-14(2)9-17(8-13)22-11-16(10-21)20-23-19(12-27-20)15-3-5-18(6-4-15)24(25)26/h3-9,11-12,22H,1-2H3