3-methyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione

Systemtic Name: 3-methyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione Openeye Name: 3-methyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione CAS Name: 3-methyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione IUPAC Name: 3-methyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione Traditional Name: 3-methyl-5-phenyl-1-propyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione Formula: C16H18N4S MolecularWeight: 298.40592

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=N1)C)N=C(CNC2=S)C3=CC=CC=C3

Isomeric SMILES

CCCN1C2=C(C(=N1)C)N=C(CNC2=S)C3=CC=CC=C3

InChI

InChI=1S/C16H18N4S/c1-3-9-20-15-14(11(2)19-20)18-13(10-17-16(15)21)12-7-5-4-6-8-12/h4-8H,3,9-10H2,1-2H3,(H,17,21)