N-[(4-butyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-methoxy-benzamide

Systemtic Name: N-[(4-butyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-methoxy-benzamide Openeye Name: N-[(4-butyl-5-isopropylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-methoxy-benzamide CAS Name: N-[[4-butyl-5-(propan-2-ylthio)-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide IUPAC Name: N-[(4-butyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]-4-methoxybenzamide Traditional Name: N-[[4-butyl-5-(isopropylthio)-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide Formula: C18H26N4O2S MolecularWeight: 362.48964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=C1SC(C)C)CNC(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCCCN1C(=NN=C1SC(C)C)CNC(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H26N4O2S/c1-5-6-11-22-16(20-21-18(22)25-13(2)3)12-19-17(23)14-7-9-15(24-4)10-8-14/h7-10,13H,5-6,11-12H2,1-4H3,(H,19,23)