N-[6-azanyl-4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-1H-pyrimidin-5-yl]thiophene-2-carboxamide

Systemtic Name: N-[6-azanyl-4-oxidanylidene-2-[2-oxidanylidene-2-(phenethylamino)ethyl]sulfanyl-1H-pyrimidin-5-yl]thiophene-2-carboxamide Openeye Name: N-[6-amino-4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-1H-pyrimidin-5-yl]thiophene-2-carboxamide CAS Name: N-[6-amino-4-oxo-2-[[2-oxo-2-(phenethylamino)ethyl]thio]-1H-pyrimidin-5-yl]-2-thiophenecarboxamide IUPAC Name: N-[6-amino-4-oxo-2-[2-oxo-2-(phenethylamino)ethyl]sulfanyl-1H-pyrimidin-5-yl]thiophene-2-carboxamide Traditional Name: N-[6-amino-4-keto-2-[[2-keto-2-(phenethylamino)ethyl]thio]-1H-pyrimidin-5-yl]thiophene-2-carboxamide Formula: C19H19N5O3S2 MolecularWeight: 429.51586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)CSC2=NC(=O)C(=C(N2)N)NC(=O)C3=CC=CS3

InChI

InChI=1S/C19H19N5O3S2/c20-16-15(22-17(26)13-7-4-10-28-13)18(27)24-19(23-16)29-11-14(25)21-9-8-12-5-2-1-3-6-12/h1-7,10H,8-9,11H2,(H,21,25)(H,22,26)(H3,20,23,24,27)