3-[6-methyl-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]propyl carbamimidothioate

Systemtic Name: 3-[6-methyl-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]propyl carbamimidothioate Openeye Name: 2-[3-(6-methyl-2,4-dioxo-1H-quinazolin-3-yl)propyl]isothiourea CAS Name: carbamimidothioic acid 3-(6-methyl-2,4-dioxo-1H-quinazolin-3-yl)propyl ester IUPAC Name: 3-(6-methyl-2,4-dioxo-1H-quinazolin-3-yl)propyl carbamimidothioate Traditional Name: 2-[3-(2,4-diketo-6-methyl-1H-quinazolin-3-yl)propyl]isothiourea Formula: C13H16N4O2S MolecularWeight: 292.35674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=O)N(C2=O)CCCSC(=N)N

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=O)N(C2=O)CCCSC(=N)N

InChI

InChI=1S/C13H16N4O2S/c1-8-3-4-10-9(7-8)11(18)17(13(19)16-10)5-2-6-20-12(14)15/h3-4,7H,2,5-6H2,1H3,(H3,14,15)(H,16,19)