3-(2-methylquinazolin-4-yl)sulfanyl-3-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: 3-(2-methylquinazolin-4-yl)sulfanyl-3-(4-nitrophenyl)prop-2-enenitrile Openeye Name: 3-(2-methylquinazolin-4-yl)sulfanyl-3-(4-nitrophenyl)prop-2-enenitrile CAS Name: 3-[(2-methyl-4-quinazolinyl)thio]-3-(4-nitrophenyl)-2-propenenitrile IUPAC Name: 3-(2-methylquinazolin-4-yl)sulfanyl-3-(4-nitrophenyl)prop-2-enenitrile Traditional Name: 3-[(2-methylquinazolin-4-yl)thio]-3-(4-nitrophenyl)acrylonitrile Formula: C18H12N4O2S MolecularWeight: 348.37848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SC(=CC#N)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SC(=CC#N)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H12N4O2S/c1-12-20-16-5-3-2-4-15(16)18(21-12)25-17(10-11-19)13-6-8-14(9-7-13)22(23)24/h2-10H,1H3