N-methyl-N-phenyl-2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-methyl-N-phenyl-2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-methyl-N-phenyl-2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-methyl-N-phenyl-2-[[5-propyl-4-(1-pyrrolyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-methyl-N-phenyl-2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-methyl-N-phenyl-2-[(5-propyl-4-pyrrol-1-yl-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H21N5OS MolecularWeight: 355.45724

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1N2C=CC=C2)SCC(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CCCC1=NN=C(N1N2C=CC=C2)SCC(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C18H21N5OS/c1-3-9-16-19-20-18(23(16)22-12-7-8-13-22)25-14-17(24)21(2)15-10-5-4-6-11-15/h4-8,10-13H,3,9,14H2,1-2H3