3,4-dihydro-1H-isoquinolin-2-yl-[3-methyl-1-[propyl(pyridin-4-yl)amino]indol-5-yl]carbamic acid

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-methyl-1-[propyl(pyridin-4-yl)amino]indol-5-yl]carbamic acid Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-methyl-1-[propyl(4-pyridyl)amino]indol-5-yl]carbamic acid CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-methyl-1-[propyl(pyridin-4-yl)amino]-5-indolyl]carbamic acid IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-methyl-1-[propyl(pyridin-4-yl)amino]indol-5-yl]carbamic acid Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[3-methyl-1-[propyl(4-pyridyl)amino]indol-5-yl]carbamic acid Formula: C27H29N5O2 MolecularWeight: 455.55146

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=NC=C1)N2C=C(C3=C2C=CC(=C3)N(C(=O)O)N4CCC5=CC=CC=C5C4)C

Isomeric SMILES

CCCN(C1=CC=NC=C1)N2C=C(C3=C2C=CC(=C3)N(C(=O)O)N4CCC5=CC=CC=C5C4)C

InChI

InChI=1S/C27H29N5O2/c1-3-15-30(23-10-13-28-14-11-23)31-18-20(2)25-17-24(8-9-26(25)31)32(27(33)34)29-16-12-21-6-4-5-7-22(21)19-29/h4-11,13-14,17-18H,3,12,15-16,19H2,1-2H3,(H,33,34)