N-(cyclopropylmethyl)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-(cyclopropylmethyl)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-N-(cyclopropylmethyl)-1-(4-methyl-7-methylsulfonyl-quinazolin-2-yl)piperidine-4-carboxamide CAS Name: N-(cyclopropylmethyl)-1-(4-methyl-7-methylsulfonyl-2-quinazolinyl)-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-N-(cyclopropylmethyl)-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-4-carboxamide Traditional Name: N-benzyl-N-(cyclopropylmethyl)-1-(7-mesyl-4-methyl-quinazolin-2-yl)isonipecotamide Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)N(CC4CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=NC(=NC2=C1C=CC(=C2)S(=O)(=O)C)N3CCC(CC3)C(=O)N(CC4CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H32N4O3S/c1-19-24-11-10-23(35(2,33)34)16-25(24)29-27(28-19)30-14-12-22(13-15-30)26(32)31(18-21-8-9-21)17-20-6-4-3-5-7-20/h3-7,10-11,16,21-22H,8-9,12-15,17-18H2,1-2H3