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

Systemtic Name: 3-butyl-1-ethyl-5-phenyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione Openeye Name: 3-butyl-1-ethyl-5-phenyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione CAS Name: 3-butyl-1-ethyl-5-phenyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione IUPAC Name: 3-butyl-1-ethyl-5-phenyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione Traditional Name: 3-butyl-1-ethyl-5-phenyl-6,7-dihydropyrazolo[4,3-e][1,4]diazepine-8-thione Formula: C18H22N4S MolecularWeight: 326.45908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN(C2=C1N=C(CNC2=S)C3=CC=CC=C3)CC

Isomeric SMILES

CCCCC1=NN(C2=C1N=C(CNC2=S)C3=CC=CC=C3)CC

InChI

InChI=1S/C18H22N4S/c1-3-5-11-14-16-17(22(4-2)21-14)18(23)19-12-15(20-16)13-9-7-6-8-10-13/h6-10H,3-5,11-12H2,1-2H3,(H,19,23)