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

Systemtic Name: 7-[2-(1,3-benzothiazol-2-yl)pyrrolidin-1-yl]carbonyl-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 7-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-3-(3-methoxypropyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 7-[[2-(1,3-benzothiazol-2-yl)-1-pyrrolidinyl]-oxomethyl]-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 7-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-3-(3-methoxypropyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 7-[2-(1,3-benzothiazol-2-yl)pyrrolidine-1-carbonyl]-3-(3-methoxypropyl)-2-thioxo-1H-quinazolin-4-one Formula: C24H24N4O3S2 MolecularWeight: 480.60236

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCCC3C4=NC5=CC=CC=C5S4)NC1=S

Isomeric SMILES

COCCCN1C(=O)C2=C(C=C(C=C2)C(=O)N3CCCC3C4=NC5=CC=CC=C5S4)NC1=S

InChI

InChI=1S/C24H24N4O3S2/c1-31-13-5-12-28-23(30)16-10-9-15(14-18(16)26-24(28)32)22(29)27-11-4-7-19(27)21-25-17-6-2-3-8-20(17)33-21/h2-3,6,8-10,14,19H,4-5,7,11-13H2,1H3,(H,26,32)