N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-6-piperidin-1-yl-quinazolin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloranyl-6-piperidin-1-yl-quinazolin-4-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-6-(1-piperidyl)quinazolin-4-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-6-(1-piperidinyl)-4-quinazolinamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-chloro-6-piperidin-1-ylquinazolin-4-amine Traditional Name: (2-chloro-6-piperidino-quinazolin-4-yl)-piperonyl-amine Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC3=C(C=C2)N=C(N=C3NCC4=CC5=C(C=C4)OCO5)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC3=C(C=C2)N=C(N=C3NCC4=CC5=C(C=C4)OCO5)Cl

InChI

InChI=1S/C21H21ClN4O2/c22-21-24-17-6-5-15(26-8-2-1-3-9-26)11-16(17)20(25-21)23-12-14-4-7-18-19(10-14)28-13-27-18/h4-7,10-11H,1-3,8-9,12-13H2,(H,23,24,25)