(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl N'-(furan-2-ylmethyl)carbamimidothioate hydrochloride

Systemtic Name: (7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl N'-(furan-2-ylmethyl)carbamimidothioate hydrochloride Openeye Name: 2-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-3-(2-furylmethyl)isothiourea hydrochloride CAS Name: N'-(2-furanylmethyl)carbamimidothioic acid (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester hydrochloride IUPAC Name: (7-chloro-4-oxo-1H-quinazolin-2-yl)methyl N'-(furan-2-ylmethyl)carbamimidothioate hydrochloride Traditional Name: 2-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-3-(2-furfuryl)isothiourea hydrochloride Formula: C15H14Cl2N4O2S MolecularWeight: 385.26826

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN=C(N)SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl.Cl

Isomeric SMILES

C1=COC(=C1)CN=C(N)SCC2=NC(=O)C3=C(N2)C=C(C=C3)Cl.Cl

InChI

InChI=1S/C15H13ClN4O2S.ClH/c16-9-3-4-11-12(6-9)19-13(20-14(11)21)8-23-15(17)18-7-10-2-1-5-22-10;/h1-6H,7-8H2,(H2,17,18)(H,19,20,21);1H