N-[6-azanyl-4-oxidanylidene-2-[2-oxidanylidene-2-(propylamino)ethyl]sulfanyl-1H-pyrimidin-5-yl]-4-ethoxy-benzamide

Systemtic Name: N-[6-azanyl-4-oxidanylidene-2-[2-oxidanylidene-2-(propylamino)ethyl]sulfanyl-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Openeye Name: N-[6-amino-4-oxo-2-[2-oxo-2-(propylamino)ethyl]sulfanyl-1H-pyrimidin-5-yl]-4-ethoxy-benzamide CAS Name: N-[6-amino-4-oxo-2-[[2-oxo-2-(propylamino)ethyl]thio]-1H-pyrimidin-5-yl]-4-ethoxybenzamide IUPAC Name: N-[6-amino-4-oxo-2-[2-oxo-2-(propylamino)ethyl]sulfanyl-1H-pyrimidin-5-yl]-4-ethoxybenzamide Traditional Name: N-[6-amino-4-keto-2-[[2-keto-2-(propylamino)ethyl]thio]-1H-pyrimidin-5-yl]-4-ethoxy-benzamide Formula: C18H23N5O4S MolecularWeight: 405.47132

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCNC(=O)CSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C18H23N5O4S/c1-3-9-20-13(24)10-28-18-22-15(19)14(17(26)23-18)21-16(25)11-5-7-12(8-6-11)27-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,20,24)(H,21,25)(H3,19,22,23,26)