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

Systemtic Name: 4-[2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]-N-(2-methoxyphenyl)benzamide Openeye Name: 4-[[2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-(2-methoxyphenyl)benzamide CAS Name: 4-[[2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]-N-(2-methoxyphenyl)benzamide IUPAC Name: 4-[[2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-(2-methoxyphenyl)benzamide Traditional Name: 4-[[2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-N-(2-methoxyphenyl)benzamide Formula: C22H20N6O3S2 MolecularWeight: 480.5626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NN=C(N3N)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)NC(=O)CSC3=NN=C(N3N)C4=CC=CS4

InChI

InChI=1S/C22H20N6O3S2/c1-31-17-6-3-2-5-16(17)25-21(30)14-8-10-15(11-9-14)24-19(29)13-33-22-27-26-20(28(22)23)18-7-4-12-32-18/h2-12H,13,23H2,1H3,(H,24,29)(H,25,30)