3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]azanium

Systemtic Name: 3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]azanium Openeye Name: 3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-[[5-(2-chlorophenyl)-2-thienyl]methyl]ammonium CAS Name: 3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-[[5-(2-chlorophenyl)-2-thiophenyl]methyl]ammonium IUPAC Name: 3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-[[5-(2-chlorophenyl)thiophen-2-yl]methyl]azanium Traditional Name: 3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl-[[5-(2-chlorophenyl)-2-thienyl]methyl]ammonium Formula: C18H19ClN5S+ MolecularWeight: 372.89496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(S2)C[NH2+]CCCC3=C(C(=NN3)N)C#N)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(S2)C[NH2+]CCCC3=C(C(=NN3)N)C#N)Cl

InChI

InChI=1S/C18H18ClN5S/c19-15-5-2-1-4-13(15)17-8-7-12(25-17)11-22-9-3-6-16-14(10-20)18(21)24-23-16/h1-2,4-5,7-8,22H,3,6,9,11H2,(H3,21,23,24)/p+1