ethyl N'-[4-aminocarbonyl-3-(oxiran-2-ylmethyl)-1,2-dihydroimidazol-5-yl]-N-phenyl-carbamimidothioate

Systemtic Name: ethyl N'-[4-aminocarbonyl-3-(oxiran-2-ylmethyl)-1,2-dihydroimidazol-5-yl]-N-phenyl-carbamimidothioate Openeye Name: 5-[[anilino(ethylsulfanyl)methylene]amino]-3-(oxiran-2-ylmethyl)-1,2-dihydroimidazole-4-carboxamide CAS Name: N'-[4-carbamoyl-3-(2-oxiranylmethyl)-1,2-dihydroimidazol-5-yl]-N-phenylcarbamimidothioic acid ethyl ester IUPAC Name: ethyl N'-[4-carbamoyl-3-(oxiran-2-ylmethyl)-1,2-dihydroimidazol-5-yl]-N-phenylcarbamimidothioate Traditional Name: 5-[[anilino-(ethylthio)methylene]amino]-3-glycidyl-4-imidazoline-4-carboxamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=NC1=C(N(CN1)CC2CO2)C(=O)N)NC3=CC=CC=C3

Isomeric SMILES

CCSC(=NC1=C(N(CN1)CC2CO2)C(=O)N)NC3=CC=CC=C3

InChI

InChI=1S/C16H21N5O2S/c1-2-24-16(19-11-6-4-3-5-7-11)20-15-13(14(17)22)21(10-18-15)8-12-9-23-12/h3-7,12,18H,2,8-10H2,1H3,(H2,17,22)(H,19,20)