6-chloranyl-3-methyl-4-(nitromethyl)-4-phenyl-1H-quinazoline-2-thione

Systemtic Name: 6-chloranyl-3-methyl-4-(nitromethyl)-4-phenyl-1H-quinazoline-2-thione Openeye Name: 6-chloro-3-methyl-4-(nitromethyl)-4-phenyl-1H-quinazoline-2-thione CAS Name: 6-chloro-3-methyl-4-(nitromethyl)-4-phenyl-1H-quinazoline-2-thione IUPAC Name: 6-chloro-3-methyl-4-(nitromethyl)-4-phenyl-1H-quinazoline-2-thione Traditional Name: 6-chloro-3-methyl-4-(nitromethyl)-4-phenyl-1H-quinazoline-2-thione Formula: C16H14ClN3O2S MolecularWeight: 347.81926

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)NC2=C(C1(C[N+](=O)[O-])C3=CC=CC=C3)C=C(C=C2)Cl

Isomeric SMILES

CN1C(=S)NC2=C(C1(C[N+](=O)[O-])C3=CC=CC=C3)C=C(C=C2)Cl

InChI

InChI=1S/C16H14ClN3O2S/c1-19-15(23)18-14-8-7-12(17)9-13(14)16(19,10-20(21)22)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,18,23)