N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-butoxy-benzamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-butoxy-benzamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-butoxy-benzamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-1,3,4-thiadiazol-2-yl]-4-butoxybenzamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-1,3,4-thiadiazol-2-yl]-4-butoxybenzamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-1,3,4-thiadiazol-2-yl]-4-butoxy-benzamide Formula: C15H18N4O3S2 MolecularWeight: 366.45842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC(=O)N

InChI

InChI=1S/C15H18N4O3S2/c1-2-3-8-22-11-6-4-10(5-7-11)13(21)17-14-18-19-15(24-14)23-9-12(16)20/h4-7H,2-3,8-9H2,1H3,(H2,16,20)(H,17,18,21)