N-[[4-(cyclopropylcarbonylamino)phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide

Systemtic Name: N-[[4-(cyclopropylcarbonylamino)phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Openeye Name: N-[[4-(cyclopropanecarbonylamino)phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide CAS Name: N-[[4-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide IUPAC Name: N-[[4-(cyclopropanecarbonylamino)phenyl]methyl]-1-methylsulfonyl-3,4-dihydro-2H-quinoline-6-carboxamide Traditional Name: N-[4-(cyclopropanecarbonylamino)benzyl]-1-mesyl-3,4-dihydro-2H-quinoline-6-carboxamide Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NCC3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

CS(=O)(=O)N1CCCC2=C1C=CC(=C2)C(=O)NCC3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C22H25N3O4S/c1-30(28,29)25-12-2-3-17-13-18(8-11-20(17)25)21(26)23-14-15-4-9-19(10-5-15)24-22(27)16-6-7-16/h4-5,8-11,13,16H,2-3,6-7,12,14H2,1H3,(H,23,26)(H,24,27)