2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[2,6-bis(oxidanylidene)-3-phenethyl-pyrimidin-4-yl]ethanamide

Systemtic Name: 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-[2,6-bis(oxidanylidene)-3-phenethyl-pyrimidin-4-yl]ethanamide Openeye Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(2,6-dioxo-3-phenethyl-pyrimidin-4-yl)acetamide CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]-N-(2,6-dioxo-3-phenethyl-4-pyrimidinyl)acetamide IUPAC Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(2,6-dioxo-3-phenethylpyrimidin-4-yl)acetamide Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]-N-(2,6-diketo-3-phenethyl-pyrimidin-4-yl)acetamide Formula: C18H18N6O4S MolecularWeight: 414.43832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=CC(=O)NC2=O)NC(=O)CSC3=NC(=O)C=C(N3)N

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=CC(=O)NC2=O)NC(=O)CSC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C18H18N6O4S/c19-12-8-14(25)22-17(20-12)29-10-16(27)21-13-9-15(26)23-18(28)24(13)7-6-11-4-2-1-3-5-11/h1-5,8-9H,6-7,10H2,(H,21,27)(H,23,26,28)(H3,19,20,22,25)