N-[2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-4-methoxy-benzamide

Systemtic Name: N-[2-[[4-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-4-methoxy-benzamide Openeye Name: N-[2-[[4-(3-amino-3-oxo-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-4-methoxy-benzamide CAS Name: N-[2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[2-[[4-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-4-methoxybenzamide Traditional Name: N-[2-[[4-(3-amino-3-keto-propyl)-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]-4-methoxy-benzamide Formula: C19H19N5O4S2 MolecularWeight: 445.51526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2CCC(=O)N)C3=CC=CS3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2CCC(=O)N)C3=CC=CS3

InChI

InChI=1S/C19H19N5O4S2/c1-28-13-6-4-12(5-7-13)18(27)21-16(26)11-30-19-23-22-17(14-3-2-10-29-14)24(19)9-8-15(20)25/h2-7,10H,8-9,11H2,1H3,(H2,20,25)(H,21,26,27)