4-(1,3-diphenylpyrazol-4-yl)-3,4,5,6,7,8-hexahydro-1H-quinazoline-2-thione

Systemtic Name: 4-(1,3-diphenylpyrazol-4-yl)-3,4,5,6,7,8-hexahydro-1H-quinazoline-2-thione Openeye Name: 4-(1,3-diphenylpyrazol-4-yl)-3,4,5,6,7,8-hexahydro-1H-quinazoline-2-thione CAS Name: 4-(1,3-diphenyl-4-pyrazolyl)-3,4,5,6,7,8-hexahydro-1H-quinazoline-2-thione IUPAC Name: 4-(1,3-diphenylpyrazol-4-yl)-3,4,5,6,7,8-hexahydro-1H-quinazoline-2-thione Traditional Name: 4-(1,3-diphenylpyrazol-4-yl)-3,4,5,6,7,8-hexahydro-1H-quinazoline-2-thione Formula: C23H22N4S MolecularWeight: 386.51258

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(NC(=S)N2)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C(NC(=S)N2)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C23H22N4S/c28-23-24-20-14-8-7-13-18(20)22(25-23)19-15-27(17-11-5-2-6-12-17)26-21(19)16-9-3-1-4-10-16/h1-6,9-12,15,22H,7-8,13-14H2,(H2,24,25,28)