N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-4-chloranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-4-chloro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-4-chloro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-4-chloro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-4-chloro-3-pyrrolidinosulfonyl-benzamide Formula: C18H21ClN6O3S MolecularWeight: 436.91574

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCC3=C(C(=NN3)N)C#N)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NCCCC3=C(C(=NN3)N)C#N)Cl

InChI

InChI=1S/C18H21ClN6O3S/c19-14-6-5-12(10-16(14)29(27,28)25-8-1-2-9-25)18(26)22-7-3-4-15-13(11-20)17(21)24-23-15/h5-6,10H,1-4,7-9H2,(H,22,26)(H3,21,23,24)