N-(3-butoxypropyl)-3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-(3-butoxypropyl)-3-(2-methylpropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: N-(3-butoxypropyl)-3-isobutyl-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-(3-butoxypropyl)-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-(3-butoxypropyl)-3-(2-methylpropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3-butoxypropyl)-3-isobutyl-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC(C)C

Isomeric SMILES

CCCCOCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=S)N2)CC(C)C

InChI

InChI=1S/C20H29N3O3S/c1-4-5-10-26-11-6-9-21-18(24)15-7-8-16-17(12-15)22-20(27)23(19(16)25)13-14(2)3/h7-8,12,14H,4-6,9-11,13H2,1-3H3,(H,21,24)(H,22,27)