4-oxidanylidene-3-(oxolan-2-ylmethyl)-N-(3-piperidin-1-ylpropyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 4-oxidanylidene-3-(oxolan-2-ylmethyl)-N-(3-piperidin-1-ylpropyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 4-oxo-N-[3-(1-piperidyl)propyl]-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 4-oxo-3-(2-oxolanylmethyl)-N-[3-(1-piperidinyl)propyl]-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 4-oxo-3-(oxolan-2-ylmethyl)-N-(3-piperidin-1-ylpropyl)-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 4-keto-N-(3-piperidinopropyl)-3-(tetrahydrofurfuryl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC4CCCO4

Isomeric SMILES

C1CCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC4CCCO4

InChI

InChI=1S/C22H30N4O3S/c27-20(23-9-5-12-25-10-2-1-3-11-25)16-7-8-18-19(14-16)24-22(30)26(21(18)28)15-17-6-4-13-29-17/h7-8,14,17H,1-6,9-13,15H2,(H,23,27)(H,24,30)