N2-[(1-phenethylsulfonylpiperidin-4-yl)methyl]quinazoline-2,4-diamine

Systemtic Name: N2-[(1-phenethylsulfonylpiperidin-4-yl)methyl]quinazoline-2,4-diamine Openeye Name: N2-[(1-phenethylsulfonyl-4-piperidyl)methyl]quinazoline-2,4-diamine CAS Name: N2-[(1-phenethylsulfonyl-4-piperidinyl)methyl]quinazoline-2,4-diamine IUPAC Name: 2-N-[(1-phenethylsulfonylpiperidin-4-yl)methyl]quinazoline-2,4-diamine Traditional Name: (4-aminoquinazolin-2-yl)-[(1-phenethylsulfonyl-4-piperidyl)methyl]amine Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNC2=NC3=CC=CC=C3C(=N2)N)S(=O)(=O)CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1CNC2=NC3=CC=CC=C3C(=N2)N)S(=O)(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C22H27N5O2S/c23-21-19-8-4-5-9-20(19)25-22(26-21)24-16-18-10-13-27(14-11-18)30(28,29)15-12-17-6-2-1-3-7-17/h1-9,18H,10-16H2,(H3,23,24,25,26)