N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-(2-cyclopropyl-1,3-benzoxazol-5-yl)-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC=C(C=C4)CSC5=NC=NN5

Isomeric SMILES

C1CC1C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC=C(C=C4)CSC5=NC=NN5

InChI

InChI=1S/C20H17N5O2S/c26-18(13-3-1-12(2-4-13)10-28-20-21-11-22-25-20)23-15-7-8-17-16(9-15)24-19(27-17)14-5-6-14/h1-4,7-9,11,14H,5-6,10H2,(H,23,26)(H,21,22,25)