N-(furan-2-ylmethyl)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-furylmethyl)propanamide CAS Name: N-(2-furanylmethyl)-2-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(furan-2-ylmethyl)propanamide Traditional Name: 2-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-(2-furfuryl)propionamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CO1)SC2=NN=C(N2C)CC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NCC1=CC=CO1)SC2=NN=C(N2C)CC3=CC=CC=C3

InChI

InChI=1S/C18H20N4O2S/c1-13(17(23)19-12-15-9-6-10-24-15)25-18-21-20-16(22(18)2)11-14-7-4-3-5-8-14/h3-10,13H,11-12H2,1-2H3,(H,19,23)