7-(4-cyclopropylcarbonylpiperazin-1-yl)carbonyl-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 7-(4-cyclopropylcarbonylpiperazin-1-yl)carbonyl-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-3-(3-methoxypropyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[4-(cyclopropanecarbonyl)piperazine-1-carbonyl]-3-(3-methoxypropyl)-2-thioxo-1H-quinazolin-4-one Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4CC4)NC1=S

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCN(CC3)C(=O)C4CC4)NC1=S

InChI

InChI=1S/C21H26N4O4S/c1-29-12-2-7-25-20(28)16-6-5-15(13-17(16)22-21(25)30)19(27)24-10-8-23(9-11-24)18(26)14-3-4-14/h5-6,13-14H,2-4,7-12H2,1H3,(H,22,30)