N-[2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethyl]cyclopropanecarboxamide

Systemtic Name: N-[2-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethyl]cyclopropanecarboxamide Openeye Name: N-[2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]ethyl]cyclopropanecarboxamide CAS Name: N-[2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylthio]ethyl]cyclopropanecarboxamide IUPAC Name: N-[2-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methylsulfanyl]ethyl]cyclopropanecarboxamide Traditional Name: N-[2-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methylthio]ethyl]cyclopropanecarboxamide Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CSCCNC(=O)C3CC3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CSCCNC(=O)C3CC3)OC

InChI

InChI=1S/C17H21N3O4S/c1-23-13-7-11-12(8-14(13)24-2)19-15(20-17(11)22)9-25-6-5-18-16(21)10-3-4-10/h7-8,10H,3-6,9H2,1-2H3,(H,18,21)(H,19,20,22)