(6R)-N-[(1S)-2-azanyl-1-[3-[(3-methylimidazol-4-yl)carbonylamino]phenyl]ethyl]-6-tert-butyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide

Systemtic Name: (6R)-N-[(1S)-2-azanyl-1-[3-[(3-methylimidazol-4-yl)carbonylamino]phenyl]ethyl]-6-tert-butyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Openeye Name: (6R)-N-[(1S)-2-amino-1-[3-[(3-methylimidazole-4-carbonyl)amino]phenyl]ethyl]-6-tert-butyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide CAS Name: (6R)-N-[(1S)-2-amino-1-[3-[[(3-methyl-4-imidazolyl)-oxomethyl]amino]phenyl]ethyl]-6-tert-butyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide IUPAC Name: (6R)-N-[(1S)-2-amino-1-[3-[(3-methylimidazole-4-carbonyl)amino]phenyl]ethyl]-6-tert-butyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Traditional Name: (6R)-N-[(1S)-2-amino-1-[3-[(3-methylimidazole-4-carbonyl)amino]phenyl]ethyl]-6-tert-butyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Formula: C29H34N6O2S MolecularWeight: 530.68426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC2=C(C1)C=C3C=C(SC3=N2)C(=O)NC(CN)C4=CC(=CC=C4)NC(=O)C5=CN=CN5C

Isomeric SMILES

CC(C)(C)[C@@H]1CCC2=C(C1)C=C3C=C(SC3=N2)C(=O)N[C@H](CN)C4=CC(=CC=C4)NC(=O)C5=CN=CN5C

InChI

InChI=1S/C29H34N6O2S/c1-29(2,3)20-8-9-22-18(11-20)10-19-13-25(38-28(19)34-22)27(37)33-23(14-30)17-6-5-7-21(12-17)32-26(36)24-15-31-16-35(24)4/h5-7,10,12-13,15-16,20,23H,8-9,11,14,30H2,1-4H3,(H,32,36)(H,33,37)/t20-,23-/m1/s1