4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-1-pentyl-quinazolin-2-one

Systemtic Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloranyl-1-pentyl-quinazolin-2-one Openeye Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]amino]-6-chloro-1-pentyl-quinazolin-2-one CAS Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]amino]-6-chloro-1-pentyl-2-quinazolinone IUPAC Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]amino]-6-chloro-1-pentylquinazolin-2-one Traditional Name: 1-amyl-6-chloro-4-[(1-piperonyl-4-piperidyl)amino]quinazolin-2-one Formula: C26H31ClN4O3 MolecularWeight: 483.00234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C=C(C=C2)Cl)C(=NC1=O)NC3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCCN1C2=C(C=C(C=C2)Cl)C(=NC1=O)NC3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H31ClN4O3/c1-2-3-4-11-31-22-7-6-19(27)15-21(22)25(29-26(31)32)28-20-9-12-30(13-10-20)16-18-5-8-23-24(14-18)34-17-33-23/h5-8,14-15,20H,2-4,9-13,16-17H2,1H3,(H,28,29,32)