1-[2,4-bis(iodanyl)phenyl]-3-[3-(1-butan-2-ylpiperidin-4-yl)-1H-indol-5-yl]thiourea

Systemtic Name: 1-[2,4-bis(iodanyl)phenyl]-3-[3-(1-butan-2-ylpiperidin-4-yl)-1H-indol-5-yl]thiourea Openeye Name: 1-(2,4-diiodophenyl)-3-[3-(1-sec-butyl-4-piperidyl)-1H-indol-5-yl]thiourea CAS Name: 1-[3-(1-butan-2-yl-4-piperidinyl)-1H-indol-5-yl]-3-(2,4-diiodophenyl)thiourea IUPAC Name: 1-[3-(1-butan-2-ylpiperidin-4-yl)-1H-indol-5-yl]-3-(2,4-diiodophenyl)thiourea Traditional Name: 1-(2,4-diiodophenyl)-3-[3-(1-sec-butyl-4-piperidyl)-1H-indol-5-yl]thiourea Formula: C24H28I2N4S MolecularWeight: 658.37986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=S)NC4=C(C=C(C=C4)I)I

Isomeric SMILES

CCC(C)N1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=S)NC4=C(C=C(C=C4)I)I

InChI

InChI=1S/C24H28I2N4S/c1-3-15(2)30-10-8-16(9-11-30)20-14-27-22-7-5-18(13-19(20)22)28-24(31)29-23-6-4-17(25)12-21(23)26/h4-7,12-16,27H,3,8-11H2,1-2H3,(H2,28,29,31)