1-[3-(1-pentan-2-yl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[3-(1-pentan-2-yl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[3-[1-(1-methylbutyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-indol-5-yl]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[3-(1-pentan-2-yl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[3-(1-pentan-2-yl-3,6-dihydro-2H-pyridin-4-yl)-1H-indol-5-yl]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[3-[1-(1-methylbutyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-indol-5-yl]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C26H29F3N4S MolecularWeight: 486.59547

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1CCC(=CC1)C2=CNC3=C2C=C(C=C3)NC(=S)NC4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CCCC(C)N1CCC(=CC1)C2=CNC3=C2C=C(C=C3)NC(=S)NC4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C26H29F3N4S/c1-3-6-17(2)33-13-11-18(12-14-33)21-16-30-23-10-9-19(15-20(21)23)31-25(34)32-24-8-5-4-7-22(24)26(27,28)29/h4-5,7-11,15-17,30H,3,6,12-14H2,1-2H3,(H2,31,32,34)