1-ethoxy-N-[5-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]methanimidate

Systemtic Name: 1-ethoxy-N-[5-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]methanimidate Openeye Name: N-[5-[2-(benzylamino)-2-oxo-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxy-methanimidate CAS Name: 1-ethoxy-N-[5-[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]-1,3,4-thiadiazol-2-yl]methanimidate IUPAC Name: N-[5-[2-(benzylamino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-1-ethoxymethanimidate Traditional Name: N-[5-[[2-(benzylamino)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]-1-ethoxy-formimidate Formula: C14H15N4O3S2- MolecularWeight: 351.4239

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=NC1=NN=C(S1)SCC(=O)NCC2=CC=CC=C2)[O-]

Isomeric SMILES

CCOC(=NC1=NN=C(S1)SCC(=O)NCC2=CC=CC=C2)[O-]

InChI

InChI=1S/C14H16N4O3S2/c1-2-21-13(20)16-12-17-18-14(23-12)22-9-11(19)15-8-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,15,19)(H,16,17,20)/p-1