7-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]carbonyl-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-[4-[2-(4-methylphenyl)ethyl]piperidin-1-yl]carbonyl-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-allyl-7-[4-[2-(p-tolyl)ethyl]piperidine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[4-[2-(4-methylphenyl)ethyl]-1-piperidinyl]-oxomethyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-[2-(4-methylphenyl)ethyl]piperidine-1-carbonyl]-3-prop-2-enyl-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-allyl-7-[4-[2-(p-tolyl)ethyl]piperidine-1-carbonyl]-2-thioxo-1H-quinazolin-4-one Formula: C26H29N3O2S MolecularWeight: 447.59236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC=C

Isomeric SMILES

CC1=CC=C(C=C1)CCC2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CC=C

InChI

InChI=1S/C26H29N3O2S/c1-3-14-29-25(31)22-11-10-21(17-23(22)27-26(29)32)24(30)28-15-12-20(13-16-28)9-8-19-6-4-18(2)5-7-19/h3-7,10-11,17,20H,1,8-9,12-16H2,2H3,(H,27,32)