N-[(5-chloranylthiophen-2-yl)methyl]-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-[(5-chloranylthiophen-2-yl)methyl]-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide Openeye Name: N-[(5-chloro-2-thienyl)methyl]-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide CAS Name: N-[(5-chloro-2-thiophenyl)methyl]-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-methylacetamide IUPAC Name: N-[(5-chlorothiophen-2-yl)methyl]-2-[(4-cyclopropyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-methylacetamide Traditional Name: N-[(5-chloro-2-thienyl)methyl]-2-[[4-cyclopropyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide Formula: C18H18ClN5OS2 MolecularWeight: 419.95142

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(S1)Cl)C(=O)CSC2=NN=C(N2C3CC3)C4=CC=NC=C4

Isomeric SMILES

CN(CC1=CC=C(S1)Cl)C(=O)CSC2=NN=C(N2C3CC3)C4=CC=NC=C4

InChI

InChI=1S/C18H18ClN5OS2/c1-23(10-14-4-5-15(19)27-14)16(25)11-26-18-22-21-17(24(18)13-2-3-13)12-6-8-20-9-7-12/h4-9,13H,2-3,10-11H2,1H3