6-chloranyl-3-methyl-4-phenyl-2-sulfanylidene-1H-quinazoline-4-carbonitrile

Systemtic Name: 6-chloranyl-3-methyl-4-phenyl-2-sulfanylidene-1H-quinazoline-4-carbonitrile Openeye Name: 6-chloro-3-methyl-4-phenyl-2-thioxo-1H-quinazoline-4-carbonitrile CAS Name: 6-chloro-3-methyl-4-phenyl-2-sulfanylidene-1H-quinazoline-4-carbonitrile IUPAC Name: 6-chloro-3-methyl-4-phenyl-2-sulfanylidene-1H-quinazoline-4-carbonitrile Traditional Name: 6-chloro-3-methyl-4-phenyl-2-thioxo-1H-quinazoline-4-carbonitrile Formula: C16H12ClN3S MolecularWeight: 313.80458

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=S)NC2=C(C1(C#N)C3=CC=CC=C3)C=C(C=C2)Cl

Isomeric SMILES

CN1C(=S)NC2=C(C1(C#N)C3=CC=CC=C3)C=C(C=C2)Cl

InChI

InChI=1S/C16H12ClN3S/c1-20-15(21)19-14-8-7-12(17)9-13(14)16(20,10-18)11-5-3-2-4-6-11/h2-9H,1H3,(H,19,21)