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

Systemtic Name: 7-(3-methylpiperidin-1-yl)carbonyl-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-(3-methylpiperidine-1-carbonyl)-3-(tetrahydrofuran-2-ylmethyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[(3-methyl-1-piperidinyl)-oxomethyl]-3-(2-oxolanylmethyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(3-methylpiperidine-1-carbonyl)-3-(oxolan-2-ylmethyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-(3-methylpiperidine-1-carbonyl)-3-(tetrahydrofurfuryl)-2-thioxo-1H-quinazolin-4-one Formula: C20H25N3O3S MolecularWeight: 387.4958

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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)CC4CCCO4

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC4CCCO4

InChI

InChI=1S/C20H25N3O3S/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/h6-7,10,13,15H,2-5,8-9,11-12H2,1H3,(H,21,27)