methyl 2-[2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[2-[[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]thio]-4-oxo-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[2-[2-(1H-indol-3-yl)ethylamino]-2-oxoethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[2-[2-(1H-indol-3-yl)ethylamino]-2-keto-ethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)NCCC2=CNC3=CC=CC=C32

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)NCCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C19H20N4O4S/c1-27-18(26)9-13-8-16(24)23-19(22-13)28-11-17(25)20-7-6-12-10-21-15-5-3-2-4-14(12)15/h2-5,8,10,21H,6-7,9,11H2,1H3,(H,20,25)(H,22,23,24)