2-[4-(7-methoxy-6-methyl-quinolin-8-yl)-1,4-diazepan-1-yl]-1-piperazin-1-yl-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanone

Systemtic Name: 2-[4-(7-methoxy-6-methyl-quinolin-8-yl)-1,4-diazepan-1-yl]-1-piperazin-1-yl-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanone Openeye Name: 2-(2-isopropylthiazol-4-yl)-2-[4-(7-methoxy-6-methyl-8-quinolyl)-1,4-diazepan-1-yl]-1-piperazin-1-yl-ethanone CAS Name: 2-[4-(7-methoxy-6-methyl-8-quinolinyl)-1,4-diazepan-1-yl]-1-(1-piperazinyl)-2-(2-propan-2-yl-4-thiazolyl)ethanone IUPAC Name: 2-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-1-piperazin-1-yl-2-(2-propan-2-yl-1,3-thiazol-4-yl)ethanone Traditional Name: 2-(2-isopropylthiazol-4-yl)-2-[4-(7-methoxy-6-methyl-8-quinolyl)-1,4-diazepan-1-yl]-1-piperazino-ethanone Formula: C28H38N6O2S MolecularWeight: 522.70532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C(=C1)C=CC=N2)N3CCCN(CC3)C(C4=CSC(=N4)C(C)C)C(=O)N5CCNCC5)OC

Isomeric SMILES

CC1=C(C(=C2C(=C1)C=CC=N2)N3CCCN(CC3)C(C4=CSC(=N4)C(C)C)C(=O)N5CCNCC5)OC

InChI

InChI=1S/C28H38N6O2S/c1-19(2)27-31-22(18-37-27)24(28(35)34-13-9-29-10-14-34)32-11-6-12-33(16-15-32)25-23-21(7-5-8-30-23)17-20(3)26(25)36-4/h5,7-8,17-19,24,29H,6,9-16H2,1-4H3