N-[6-azanyl-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanamide

Systemtic Name: N-[6-azanyl-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-5-yl]propanamide Openeye Name: N-[6-amino-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]propanamide CAS Name: N-[6-amino-2-[[2-(4-methylanilino)-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-5-yl]propanamide IUPAC Name: N-[6-amino-2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-5-yl]propanamide Traditional Name: N-[6-amino-4-keto-2-[[2-keto-2-(p-toluidino)ethyl]thio]-1H-pyrimidin-5-yl]propionamide Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=C(NC(=NC1=O)SCC(=O)NC2=CC=C(C=C2)C)N

Isomeric SMILES

CCC(=O)NC1=C(NC(=NC1=O)SCC(=O)NC2=CC=C(C=C2)C)N

InChI

InChI=1S/C16H19N5O3S/c1-3-11(22)19-13-14(17)20-16(21-15(13)24)25-8-12(23)18-10-6-4-9(2)5-7-10/h4-7H,3,8H2,1-2H3,(H,18,23)(H,19,22)(H3,17,20,21,24)