N-[2-(1H-imidazol-5-yl)ethyl]-4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[2-(1H-imidazol-5-yl)ethyl]-4-oxidanylidene-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-3-(2-oxolanylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[2-(1H-imidazol-5-yl)ethyl]-4-oxo-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-[2-(1H-imidazol-5-yl)ethyl]-4-keto-3-(tetrahydrofurfuryl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)NCCC4=CN=CN4)NC2=S

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C=C(C=C3)C(=O)NCCC4=CN=CN4)NC2=S

InChI

InChI=1S/C19H21N5O3S/c25-17(21-6-5-13-9-20-11-22-13)12-3-4-15-16(8-12)23-19(28)24(18(15)26)10-14-2-1-7-27-14/h3-4,8-9,11,14H,1-2,5-7,10H2,(H,20,22)(H,21,25)(H,23,28)