7-(3-methylpiperidin-1-yl)carbonyl-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-(3-methylpiperidin-1-yl)carbonyl-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-allyl-7-(3-methylpiperidine-1-carbonyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[(3-methyl-1-piperidinyl)-oxomethyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-(3-methylpiperidine-1-carbonyl)-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-allyl-7-(3-methylpiperidine-1-carbonyl)-2-thioxo-1H-quinazolin-4-one Formula: C18H21N3O2S MolecularWeight: 343.44324

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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)CC=C

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2S/c1-3-8-21-17(23)14-7-6-13(10-15(14)19-18(21)24)16(22)20-9-4-5-12(2)11-20/h3,6-7,10,12H,1,4-5,8-9,11H2,2H3,(H,19,24)