2-[4-oxidanylidene-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)butyl]-1H-quinazolin-4-one

Systemtic Name: 2-[4-oxidanylidene-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)butyl]-1H-quinazolin-4-one Openeye Name: 2-[4-oxo-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)butyl]-1H-quinazolin-4-one CAS Name: 2-[4-oxo-4-[4-(1-pyrrolidinylsulfonyl)-1-piperazinyl]butyl]-1H-quinazolin-4-one IUPAC Name: 2-[4-oxo-4-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)butyl]-1H-quinazolin-4-one Traditional Name: 2-[4-keto-4-(4-pyrrolidinosulfonylpiperazino)butyl]-1H-quinazolin-4-one Formula: C20H27N5O4S MolecularWeight: 433.52448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)N2CCN(CC2)C(=O)CCCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C20H27N5O4S/c26-19(9-5-8-18-21-17-7-2-1-6-16(17)20(27)22-18)23-12-14-25(15-13-23)30(28,29)24-10-3-4-11-24/h1-2,6-7H,3-5,8-15H2,(H,21,22,27)