7-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-[4-(2,3-dimethylphenyl)piperazin-1-yl]carbonyl-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3-(3-methoxypropyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[4-(2,3-dimethylphenyl)-1-piperazinyl]-oxomethyl]-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-(2,3-dimethylphenyl)piperazine-1-carbonyl]-3-(3-methoxypropyl)-2-thioxo-1H-quinazolin-4-one Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CCCOC)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)C(=O)N(C(=S)N4)CCCOC)C

InChI

InChI=1S/C25H30N4O3S/c1-17-6-4-7-22(18(17)2)27-11-13-28(14-12-27)23(30)19-8-9-20-21(16-19)26-25(33)29(24(20)31)10-5-15-32-3/h4,6-9,16H,5,10-15H2,1-3H3,(H,26,33)