4-azanyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-sulfanylidene-1,3-thiazole-5-carboxamide

Systemtic Name: 4-azanyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-sulfanylidene-1,3-thiazole-5-carboxamide Openeye Name: 4-amino-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-thioxo-thiazole-5-carboxamide CAS Name: 4-amino-N-[2-(4-morpholin-4-iumyl)ethyl]-3-phenyl-2-sulfanylidene-5-thiazolecarboxamide IUPAC Name: 4-amino-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-sulfanylidene-1,3-thiazole-5-carboxamide Traditional Name: 4-amino-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-thioxo-4-thiazoline-5-carboxamide Formula: C16H21N4O2S2+ MolecularWeight: 365.49354

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)C2=C(N(C(=S)S2)C3=CC=CC=C3)N

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)C2=C(N(C(=S)S2)C3=CC=CC=C3)N

InChI

InChI=1S/C16H20N4O2S2/c17-14-13(15(21)18-6-7-19-8-10-22-11-9-19)24-16(23)20(14)12-4-2-1-3-5-12/h1-5H,6-11,17H2,(H,18,21)/p+1