1-cyclopentyl-3-ethyl-7-(4-methylsulfonylphenyl)-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one

Systemtic Name: 1-cyclopentyl-3-ethyl-7-(4-methylsulfonylphenyl)-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one Openeye Name: 1-cyclopentyl-3-ethyl-7-(4-methylsulfonylphenyl)-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one CAS Name: 1-cyclopentyl-3-ethyl-7-(4-methylsulfonylphenyl)-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one IUPAC Name: 1-cyclopentyl-3-ethyl-7-(4-methylsulfonylphenyl)-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one Traditional Name: 1-cyclopentyl-3-ethyl-7-(4-mesylphenyl)-5,6-dihydropyrazolo[3,4-e][1,4]diazepin-4-one Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C(=O)NCC(=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4CCCC4

Isomeric SMILES

CCC1=NN(C2=C1C(=O)NCC(=N2)C3=CC=C(C=C3)S(=O)(=O)C)C4CCCC4

InChI

InChI=1S/C20H24N4O3S/c1-3-16-18-19(24(23-16)14-6-4-5-7-14)22-17(12-21-20(18)25)13-8-10-15(11-9-13)28(2,26)27/h8-11,14H,3-7,12H2,1-2H3,(H,21,25)