1-[[3-(3-ethoxypropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-7-yl]carbonyl]-4-piperidin-1-yl-piperidine-4-carboxamide

Systemtic Name: 1-[[3-(3-ethoxypropyl)-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-7-yl]carbonyl]-4-piperidin-1-yl-piperidine-4-carboxamide Openeye Name: 1-[3-(3-ethoxypropyl)-4-oxo-2-thioxo-1H-quinazoline-7-carbonyl]-4-(1-piperidyl)piperidine-4-carboxamide CAS Name: 1-[[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazolin-7-yl]-oxomethyl]-4-(1-piperidinyl)-4-piperidinecarboxamide IUPAC Name: 1-[3-(3-ethoxypropyl)-4-oxo-2-sulfanylidene-1H-quinazoline-7-carbonyl]-4-piperidin-1-ylpiperidine-4-carboxamide Traditional Name: 1-[3-(3-ethoxypropyl)-4-keto-2-thioxo-1H-quinazoline-7-carbonyl]-4-piperidino-isonipecotamide Formula: C25H35N5O4S MolecularWeight: 501.6415

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)(C(=O)N)N4CCCCC4)NC1=S

Isomeric SMILES

CCOCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)(C(=O)N)N4CCCCC4)NC1=S

InChI

InChI=1S/C25H35N5O4S/c1-2-34-16-6-13-30-22(32)19-8-7-18(17-20(19)27-24(30)35)21(31)28-14-9-25(10-15-28,23(26)33)29-11-4-3-5-12-29/h7-8,17H,2-6,9-16H2,1H3,(H2,26,33)(H,27,35)