[2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl] N-phenylazepane-1-carboximidothioate

Systemtic Name: [2-oxidanylidene-2-(1,3-thiazol-2-ylamino)ethyl] N-phenylazepane-1-carboximidothioate Openeye Name: [2-oxo-2-(thiazol-2-ylamino)ethyl] N-phenylazepane-1-carboximidothioate CAS Name: N-phenyl-1-azepanecarboximidothioic acid [2-oxo-2-(2-thiazolylamino)ethyl] ester IUPAC Name: [2-oxo-2-(1,3-thiazol-2-ylamino)ethyl] N-phenylazepane-1-carboximidothioate Traditional Name: N-phenylazepane-1-carboximidothioic acid [2-keto-2-(thiazol-2-ylamino)ethyl] ester Formula: C18H22N4OS2 MolecularWeight: 374.52348

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=NC2=CC=CC=C2)SCC(=O)NC3=NC=CS3

Isomeric SMILES

C1CCCN(CC1)C(=NC2=CC=CC=C2)SCC(=O)NC3=NC=CS3

InChI

InChI=1S/C18H22N4OS2/c23-16(21-17-19-10-13-24-17)14-25-18(20-15-8-4-3-5-9-15)22-11-6-1-2-7-12-22/h3-5,8-10,13H,1-2,6-7,11-12,14H2,(H,19,21,23)