N-cyclopropyl-2-[[4-(3-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-cyclopropyl-2-[[4-(3-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-cyclopropyl-2-[[4-(m-tolyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-cyclopropyl-2-[[[4-(3-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-cyclopropyl-2-[[4-(3-methylphenyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-cyclopropyl-2-[[[4-(m-tolyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C21H19N5OS3 MolecularWeight: 453.60346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=NC(=CS3)C(=O)NC4CC4)C5=CC=CS5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SCC3=NC(=CS3)C(=O)NC4CC4)C5=CC=CS5

InChI

InChI=1S/C21H19N5OS3/c1-13-4-2-5-15(10-13)26-19(17-6-3-9-28-17)24-25-21(26)30-12-18-23-16(11-29-18)20(27)22-14-7-8-14/h2-6,9-11,14H,7-8,12H2,1H3,(H,22,27)