2-[2-[(4-azanyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-phenyl-benzamide

Systemtic Name: 2-[2-[(4-azanyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-phenyl-benzamide Openeye Name: 2-[[2-[[4-amino-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-phenyl-benzamide CAS Name: 2-[[2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[[2-[(4-amino-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-phenylbenzamide Traditional Name: 2-[[2-[[4-amino-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-N-phenyl-benzamide Formula: C22H19N7O2S MolecularWeight: 445.49696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=C(N3N)C4=CC=NC=C4

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=CC=C2NC(=O)CSC3=NN=C(N3N)C4=CC=NC=C4

InChI

InChI=1S/C22H19N7O2S/c23-29-20(15-10-12-24-13-11-15)27-28-22(29)32-14-19(30)26-18-9-5-4-8-17(18)21(31)25-16-6-2-1-3-7-16/h1-13H,14,23H2,(H,25,31)(H,26,30)