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

Systemtic Name: 2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-[(2-propan-2-ylphenyl)amino]prop-2-enenitrile Openeye Name: 2-[4-(2,4-dimethylphenyl)thiazol-2-yl]-3-(2-isopropylanilino)prop-2-enenitrile CAS Name: 2-[4-(2,4-dimethylphenyl)-2-thiazolyl]-3-(2-propan-2-ylanilino)-2-propenenitrile IUPAC Name: 2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-3-(2-propan-2-ylanilino)prop-2-enenitrile Traditional Name: 2-[4-(2,4-dimethylphenyl)thiazol-2-yl]-3-(2-isopropylanilino)acrylonitrile Formula: C23H23N3S MolecularWeight: 373.51382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=CC=C3C(C)C)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=N2)C(=CNC3=CC=CC=C3C(C)C)C#N)C

InChI

InChI=1S/C23H23N3S/c1-15(2)19-7-5-6-8-21(19)25-13-18(12-24)23-26-22(14-27-23)20-10-9-16(3)11-17(20)4/h5-11,13-15,25H,1-4H3