3-(furan-2-ylmethyl)-7-[4-(phenylmethyl)piperidin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(furan-2-ylmethyl)-7-[4-(phenylmethyl)piperidin-1-yl]carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-(4-benzylpiperidine-1-carbonyl)-3-(2-furylmethyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(2-furanylmethyl)-7-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(4-benzylpiperidine-1-carbonyl)-3-(furan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(4-benzylpiperidine-1-carbonyl)-3-(2-furfuryl)-2-thioxo-1H-quinazolin-4-one Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC5=CC=CO5

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC5=CC=CO5

InChI

InChI=1S/C26H25N3O3S/c30-24(28-12-10-19(11-13-28)15-18-5-2-1-3-6-18)20-8-9-22-23(16-20)27-26(33)29(25(22)31)17-21-7-4-14-32-21/h1-9,14,16,19H,10-13,15,17H2,(H,27,33)