[1-[(3-fluoranylpyridin-4-yl)-propyl-amino]-3-methyl-indol-5-yl] N-butylcarbamate

Systemtic Name: [1-[(3-fluoranylpyridin-4-yl)-propyl-amino]-3-methyl-indol-5-yl] N-butylcarbamate Openeye Name: [1-[(3-fluoro-4-pyridyl)-propyl-amino]-3-methyl-indol-5-yl] N-butylcarbamate CAS Name: N-butylcarbamic acid [1-[(3-fluoro-4-pyridinyl)-propylamino]-3-methyl-5-indolyl] ester IUPAC Name: [1-[(3-fluoropyridin-4-yl)-propylamino]-3-methylindol-5-yl] N-butylcarbamate Traditional Name: N-butylcarbamic acid [1-[(3-fluoro-4-pyridyl)-propyl-amino]-3-methyl-indol-5-yl] ester Formula: C22H27FN4O2 MolecularWeight: 398.473783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)OC1=CC2=C(C=C1)N(C=C2C)N(CCC)C3=C(C=NC=C3)F

Isomeric SMILES

CCCCNC(=O)OC1=CC2=C(C=C1)N(C=C2C)N(CCC)C3=C(C=NC=C3)F

InChI

InChI=1S/C22H27FN4O2/c1-4-6-10-25-22(28)29-17-7-8-20-18(13-17)16(3)15-27(20)26(12-5-2)21-9-11-24-14-19(21)23/h7-9,11,13-15H,4-6,10,12H2,1-3H3,(H,25,28)