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

Systemtic Name: 3-[(3,4-dimethylphenyl)amino]-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: 3-(3,4-dimethylanilino)-2-[4-(3-methoxyphenyl)thiazol-2-yl]prop-2-enenitrile CAS Name: 3-(3,4-dimethylanilino)-2-[4-(3-methoxyphenyl)-2-thiazolyl]-2-propenenitrile IUPAC Name: 3-(3,4-dimethylanilino)-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: 3-(3,4-dimethylanilino)-2-[4-(3-methoxyphenyl)thiazol-2-yl]acrylonitrile Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)OC)C

InChI

InChI=1S/C21H19N3OS/c1-14-7-8-18(9-15(14)2)23-12-17(11-22)21-24-20(13-26-21)16-5-4-6-19(10-16)25-3/h4-10,12-13,23H,1-3H3