N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]propanamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]propanamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)propanamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)propionamide Formula: C23H30N8O3S MolecularWeight: 498.6011

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)NCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)NCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C23H30N8O3S/c1-30-20-8-7-16(35(33,34)31-12-3-2-4-13-31)14-19(20)27-21(30)9-10-22(32)26-11-5-6-18-17(15-24)23(25)29-28-18/h7-8,14H,2-6,9-13H2,1H3,(H,26,32)(H3,25,28,29)