N-(oxolan-2-ylmethyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: N-(oxolan-2-ylmethyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(tetrahydrofuran-2-ylmethyl)propanamide CAS Name: N-(2-oxolanylmethyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(oxolan-2-ylmethyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: 2-[(1-phenyl-1,2,4-triazol-3-yl)thio]-N-(tetrahydrofurfuryl)propionamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1CCCO1)SC2=NN(C=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NCC1CCCO1)SC2=NN(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O2S/c1-12(15(21)17-10-14-8-5-9-22-14)23-16-18-11-20(19-16)13-6-3-2-4-7-13/h2-4,6-7,11-12,14H,5,8-10H2,1H3,(H,17,21)