(6R)-N-[(1S)-2-azanyl-1-[3-[(1,5-dimethylpyrazol-3-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-[(1,5-dimethylpyrazol-3-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-[(1,5-dimethylpyrazole-3-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-[[(1,5-dimethyl-3-pyrazolyl)-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-[(1,5-dimethylpyrazole-3-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-[(1,5-dimethylpyrazole-3-carbonyl)amino]phenyl]ethyl]-6-tert-butyl-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide Formula: C30H36N6O2S MolecularWeight: 544.71084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)NC2=CC=CC(=C2)C(CN)NC(=O)C3=CC4=CC5=C(CCC(C5)C(C)(C)C)N=C4S3

Isomeric SMILES

CC1=CC(=NN1C)C(=O)NC2=CC=CC(=C2)[C@@H](CN)NC(=O)C3=CC4=CC5=C(CC[C@H](C5)C(C)(C)C)N=C4S3

InChI

InChI=1S/C30H36N6O2S/c1-17-11-24(35-36(17)5)27(37)32-22-8-6-7-18(14-22)25(16-31)33-28(38)26-15-20-12-19-13-21(30(2,3)4)9-10-23(19)34-29(20)39-26/h6-8,11-12,14-15,21,25H,9-10,13,16,31H2,1-5H3,(H,32,37)(H,33,38)/t21-,25-/m1/s1