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

Systemtic Name: 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: 3-[(2-methyl-8-quinolyl)amino]-2-[4-(4-nitrophenyl)thiazol-2-yl]prop-2-enenitrile CAS Name: 3-[(2-methyl-8-quinolinyl)amino]-2-[4-(4-nitrophenyl)-2-thiazolyl]-2-propenenitrile IUPAC Name: 3-[(2-methylquinolin-8-yl)amino]-2-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: 3-[(2-methyl-8-quinolyl)amino]-2-[4-(4-nitrophenyl)thiazol-2-yl]acrylonitrile Formula: C22H15N5O2S MolecularWeight: 413.4518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC=C(C#N)C3=NC(=CS3)C4=CC=C(C=C4)[N+](=O)[O-])C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC=C(C#N)C3=NC(=CS3)C4=CC=C(C=C4)[N+](=O)[O-])C=C1

InChI

InChI=1S/C22H15N5O2S/c1-14-5-6-16-3-2-4-19(21(16)25-14)24-12-17(11-23)22-26-20(13-30-22)15-7-9-18(10-8-15)27(28)29/h2-10,12-13,24H,1H3