1-piperazin-1-yl-3-[4-(6-propan-2-ylquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one

Systemtic Name: 1-piperazin-1-yl-3-[4-(6-propan-2-ylquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one Openeye Name: 3-[4-(6-isopropyl-8-quinolyl)-1,4-diazepan-1-yl]-3-(2-isopropylthiazol-4-yl)-1-piperazin-1-yl-propan-1-one CAS Name: 1-(1-piperazinyl)-3-[4-(6-propan-2-yl-8-quinolinyl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-4-thiazolyl)-1-propanone IUPAC Name: 1-piperazin-1-yl-3-[4-(6-propan-2-ylquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propan-1-one Traditional Name: 3-[4-(6-isopropyl-8-quinolyl)-1,4-diazepan-1-yl]-3-(2-isopropylthiazol-4-yl)-1-piperazino-propan-1-one Formula: C30H42N6OS MolecularWeight: 534.75908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=C2C(=C1)C=CC=N2)N3CCCN(CC3)C(CC(=O)N4CCNCC4)C5=CSC(=N5)C(C)C

Isomeric SMILES

CC(C)C1=CC(=C2C(=C1)C=CC=N2)N3CCCN(CC3)C(CC(=O)N4CCNCC4)C5=CSC(=N5)C(C)C

InChI

InChI=1S/C30H42N6OS/c1-21(2)24-17-23-7-5-8-32-29(23)27(18-24)35-12-6-11-34(15-16-35)26(25-20-38-30(33-25)22(3)4)19-28(37)36-13-9-31-10-14-36/h5,7-8,17-18,20-22,26,31H,6,9-16,19H2,1-4H3