2-[(4-azanyl-6-oxidanylidene-3-prop-2-enyl-1H-pyrimidin-3-ium-2-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)ethanamide

Systemtic Name: 2-[(4-azanyl-6-oxidanylidene-3-prop-2-enyl-1H-pyrimidin-3-ium-2-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)ethanamide Openeye Name: 2-[(3-allyl-4-amino-6-oxo-1H-pyrimidin-3-ium-2-yl)sulfanyl]-N-(4-phenylthiazol-2-yl)acetamide CAS Name: 2-[(4-amino-6-oxo-3-prop-2-enyl-1H-pyrimidin-3-ium-2-yl)thio]-N-(4-phenyl-2-thiazolyl)acetamide IUPAC Name: 2-[(4-amino-6-oxo-3-prop-2-enyl-1H-pyrimidin-3-ium-2-yl)sulfanyl]-N-(4-phenyl-1,3-thiazol-2-yl)acetamide Traditional Name: 2-[(3-allyl-4-amino-6-keto-1H-pyrimidin-3-ium-2-yl)thio]-N-(4-phenylthiazol-2-yl)acetamide Formula: C18H18N5O2S2+ MolecularWeight: 400.49782

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C(NC(=O)C=C1N)SCC(=O)NC2=NC(=CS2)C3=CC=CC=C3

Isomeric SMILES

C=CC[N+]1=C(NC(=O)C=C1N)SCC(=O)NC2=NC(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C18H17N5O2S2/c1-2-8-23-14(19)9-15(24)22-18(23)27-11-16(25)21-17-20-13(10-26-17)12-6-4-3-5-7-12/h2-7,9-10H,1,8,11H2,(H3,19,20,21,24,25)/p+1