4-[5-(4-chlorophenyl)-3-(2-pyrrolidin-1-ylethylsulfanyl)-1H-pyrazol-4-yl]pyridine

Systemtic Name: 4-[5-(4-chlorophenyl)-3-(2-pyrrolidin-1-ylethylsulfanyl)-1H-pyrazol-4-yl]pyridine Openeye Name: 4-[5-(4-chlorophenyl)-3-(2-pyrrolidin-1-ylethylsulfanyl)-1H-pyrazol-4-yl]pyridine CAS Name: 4-[5-(4-chlorophenyl)-3-[2-(1-pyrrolidinyl)ethylthio]-1H-pyrazol-4-yl]pyridine IUPAC Name: 4-[5-(4-chlorophenyl)-3-(2-pyrrolidin-1-ylethylsulfanyl)-1H-pyrazol-4-yl]pyridine Traditional Name: 4-[5-(4-chlorophenyl)-3-(2-pyrrolidinoethylthio)-1H-pyrazol-4-yl]pyridine Formula: C20H21ClN4S MolecularWeight: 384.92554

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCSC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)CCSC2=NNC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4S/c21-17-5-3-16(4-6-17)19-18(15-7-9-22-10-8-15)20(24-23-19)26-14-13-25-11-1-2-12-25/h3-10H,1-2,11-14H2,(H,23,24)