2-[(2-chloranyl-1,3-thiazol-5-yl)methylsulfanyl]-3-(furan-2-ylmethyl)-6,7-dimethoxy-quinazolin-3-ium-4-amine

Systemtic Name: 2-[(2-chloranyl-1,3-thiazol-5-yl)methylsulfanyl]-3-(furan-2-ylmethyl)-6,7-dimethoxy-quinazolin-3-ium-4-amine Openeye Name: 2-[(2-chlorothiazol-5-yl)methylsulfanyl]-3-(2-furylmethyl)-6,7-dimethoxy-quinazolin-3-ium-4-amine CAS Name: 2-[(2-chloro-5-thiazolyl)methylthio]-3-(2-furanylmethyl)-6,7-dimethoxy-4-quinazolin-3-iumamine IUPAC Name: 2-[(2-chloro-1,3-thiazol-5-yl)methylsulfanyl]-3-(furan-2-ylmethyl)-6,7-dimethoxyquinazolin-3-ium-4-amine Traditional Name: [2-[(2-chlorothiazol-5-yl)methylthio]-3-(2-furfuryl)-6,7-dimethoxy-quinazolin-3-ium-4-yl]amine Formula: C19H18ClN4O3S2+ MolecularWeight: 449.95422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=[N+](C(=N2)SCC3=CN=C(S3)Cl)CC4=CC=CO4)N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=[N+](C(=N2)SCC3=CN=C(S3)Cl)CC4=CC=CO4)N)OC

InChI

InChI=1S/C19H17ClN4O3S2/c1-25-15-6-13-14(7-16(15)26-2)23-19(28-10-12-8-22-18(20)29-12)24(17(13)21)9-11-4-3-5-27-11/h3-8,21H,9-10H2,1-2H3/p+1