N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)benzamide Formula: C23H24N6O3S MolecularWeight: 464.54006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)S(=O)(=O)C3=CC=CC(=C3)C(=O)NCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C23H24N6O3S/c24-14-20-21(27-28-22(20)25)9-4-11-26-23(30)17-7-3-8-19(13-17)33(31,32)29-12-10-16-5-1-2-6-18(16)15-29/h1-3,5-8,13H,4,9-12,15H2,(H,26,30)(H3,25,27,28)