3-(furan-2-ylmethyl)-7-(3-methylpiperidin-1-yl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(furan-2-ylmethyl)-7-(3-methylpiperidin-1-yl)carbonyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(2-furylmethyl)-7-(3-methylpiperidine-1-carbonyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-(2-furanylmethyl)-7-[(3-methyl-1-piperidinyl)-oxomethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(furan-2-ylmethyl)-7-(3-methylpiperidine-1-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(2-furfuryl)-7-(3-methylpiperidine-1-carbonyl)-2-thioxo-1H-quinazolin-4-one Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC4=CC=CO4

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC4=CC=CO4

InChI

InChI=1S/C20H21N3O3S/c1-13-4-2-8-22(11-13)18(24)14-6-7-16-17(10-14)21-20(27)23(19(16)25)12-15-5-3-9-26-15/h3,5-7,9-10,13H,2,4,8,11-12H2,1H3,(H,21,27)