1-(4-ethoxyphenyl)-3-[3-(1-pentan-2-ylpiperidin-4-yl)-1H-indol-5-yl]thiourea

Systemtic Name: 1-(4-ethoxyphenyl)-3-[3-(1-pentan-2-ylpiperidin-4-yl)-1H-indol-5-yl]thiourea Openeye Name: 1-(4-ethoxyphenyl)-3-[3-[1-(1-methylbutyl)-4-piperidyl]-1H-indol-5-yl]thiourea CAS Name: 1-(4-ethoxyphenyl)-3-[3-(1-pentan-2-yl-4-piperidinyl)-1H-indol-5-yl]thiourea IUPAC Name: 1-(4-ethoxyphenyl)-3-[3-(1-pentan-2-ylpiperidin-4-yl)-1H-indol-5-yl]thiourea Traditional Name: 1-[3-[1-(1-methylbutyl)-4-piperidyl]-1H-indol-5-yl]-3-p-phenetyl-thiourea Formula: C27H36N4OS MolecularWeight: 464.66594

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)N1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=S)NC4=CC=C(C=C4)OCC

Isomeric SMILES

CCCC(C)N1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=S)NC4=CC=C(C=C4)OCC

InChI

InChI=1S/C27H36N4OS/c1-4-6-19(3)31-15-13-20(14-16-31)25-18-28-26-12-9-22(17-24(25)26)30-27(33)29-21-7-10-23(11-8-21)32-5-2/h7-12,17-20,28H,4-6,13-16H2,1-3H3,(H2,29,30,33)