2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-methylquinolin-8-yl)amino]prop-2-enenitrile

Systemtic Name: 2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-methylquinolin-8-yl)amino]prop-2-enenitrile Openeye Name: 2-[4-(3-methoxyphenyl)thiazol-2-yl]-3-[(2-methyl-8-quinolyl)amino]prop-2-enenitrile CAS Name: 2-[4-(3-methoxyphenyl)-2-thiazolyl]-3-[(2-methyl-8-quinolinyl)amino]-2-propenenitrile IUPAC Name: 2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-3-[(2-methylquinolin-8-yl)amino]prop-2-enenitrile Traditional Name: 2-[4-(3-methoxyphenyl)thiazol-2-yl]-3-[(2-methyl-8-quinolyl)amino]acrylonitrile Formula: C23H18N4OS MolecularWeight: 398.48022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC=C(C#N)C3=NC(=CS3)C4=CC(=CC=C4)OC)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC=C(C#N)C3=NC(=CS3)C4=CC(=CC=C4)OC)C=C1

InChI

InChI=1S/C23H18N4OS/c1-15-9-10-16-5-4-8-20(22(16)26-15)25-13-18(12-24)23-27-21(14-29-23)17-6-3-7-19(11-17)28-2/h3-11,13-14,25H,1-2H3