2-bromanyl-3-methyl-1-[1-[1-[3-(4-methylpiperazin-1-yl)propyl]indol-3-yl]-1H-isoquinolin-2-yl]butan-1-one

Systemtic Name: 2-bromanyl-3-methyl-1-[1-[1-[3-(4-methylpiperazin-1-yl)propyl]indol-3-yl]-1H-isoquinolin-2-yl]butan-1-one Openeye Name: 2-bromo-3-methyl-1-[1-[1-[3-(4-methylpiperazin-1-yl)propyl]indol-3-yl]-1H-isoquinolin-2-yl]butan-1-one CAS Name: 2-bromo-3-methyl-1-[1-[1-[3-(4-methyl-1-piperazinyl)propyl]-3-indolyl]-1H-isoquinolin-2-yl]-1-butanone IUPAC Name: 2-bromo-3-methyl-1-[1-[1-[3-(4-methylpiperazin-1-yl)propyl]indol-3-yl]-1H-isoquinolin-2-yl]butan-1-one Traditional Name: 2-bromo-3-methyl-1-[1-[1-[3-(4-methylpiperazino)propyl]indol-3-yl]-1H-isoquinolin-2-yl]butan-1-one Formula: C30H37BrN4O MolecularWeight: 549.54498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1C=CC2=CC=CC=C2C1C3=CN(C4=CC=CC=C43)CCCN5CCN(CC5)C)Br

Isomeric SMILES

CC(C)C(C(=O)N1C=CC2=CC=CC=C2C1C3=CN(C4=CC=CC=C43)CCCN5CCN(CC5)C)Br

InChI

InChI=1S/C30H37BrN4O/c1-22(2)28(31)30(36)35-16-13-23-9-4-5-10-24(23)29(35)26-21-34(27-12-7-6-11-25(26)27)15-8-14-33-19-17-32(3)18-20-33/h4-7,9-13,16,21-22,28-29H,8,14-15,17-20H2,1-3H3