N-[2-[(2-azanyl-5-chloranyl-phenyl)-cyclohexyl-methyl]sulfanylethyl]-1H-pyrazole-4-carboxamide

Systemtic Name: N-[2-[(2-azanyl-5-chloranyl-phenyl)-cyclohexyl-methyl]sulfanylethyl]-1H-pyrazole-4-carboxamide Openeye Name: N-[2-[(2-amino-5-chloro-phenyl)-cyclohexyl-methyl]sulfanylethyl]-1H-pyrazole-4-carboxamide CAS Name: N-[2-[[(2-amino-5-chlorophenyl)-cyclohexylmethyl]thio]ethyl]-1H-pyrazole-4-carboxamide IUPAC Name: N-[2-[(2-amino-5-chlorophenyl)-cyclohexylmethyl]sulfanylethyl]-1H-pyrazole-4-carboxamide Traditional Name: N-[2-[[(2-amino-5-chloro-phenyl)-cyclohexyl-methyl]thio]ethyl]-1H-pyrazole-4-carboxamide Formula: C19H25ClN4OS MolecularWeight: 392.946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=C(C=CC(=C2)Cl)N)SCCNC(=O)C3=CNN=C3

Isomeric SMILES

C1CCC(CC1)C(C2=C(C=CC(=C2)Cl)N)SCCNC(=O)C3=CNN=C3

InChI

InChI=1S/C19H25ClN4OS/c20-15-6-7-17(21)16(10-15)18(13-4-2-1-3-5-13)26-9-8-22-19(25)14-11-23-24-12-14/h6-7,10-13,18H,1-5,8-9,21H2,(H,22,25)(H,23,24)