N-[(2S)-butan-2-yl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-amine

Systemtic Name: N-[(2S)-butan-2-yl]-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidin-4-amine Openeye Name: 1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-[(1S)-1-methylpropyl]piperidin-4-amine CAS Name: N-[(2S)-butan-2-yl]-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-4-piperidinamine IUPAC Name: N-[(2S)-butan-2-yl]-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidin-4-amine Traditional Name: [1-(7-mesyl-4-methyl-quinazolin-2-yl)-4-piperidyl]-[(1S)-1-methylpropyl]amine Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC1CCN(CC1)C2=NC3=C(C=CC(=C3)S(=O)(=O)C)C(=N2)C

Isomeric SMILES

CC[C@H](C)NC1CCN(CC1)C2=NC3=C(C=CC(=C3)S(=O)(=O)C)C(=N2)C

InChI

InChI=1S/C19H28N4O2S/c1-5-13(2)20-15-8-10-23(11-9-15)19-21-14(3)17-7-6-16(26(4,24)25)12-18(17)22-19/h6-7,12-13,15,20H,5,8-11H2,1-4H3/t13-/m0/s1