1-butyl-3-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]thiourea

Systemtic Name: 1-butyl-3-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]thiourea Openeye Name: 1-butyl-3-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]thiourea CAS Name: 1-butyl-3-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]thiourea IUPAC Name: 1-butyl-3-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]thiourea Traditional Name: 1-butyl-3-[2-(2-chlorophenyl)-2-(1H-indol-3-yl)ethyl]thiourea Formula: C21H24ClN3S MolecularWeight: 385.95336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NCC(C1=CC=CC=C1Cl)C2=CNC3=CC=CC=C32

Isomeric SMILES

CCCCNC(=S)NCC(C1=CC=CC=C1Cl)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C21H24ClN3S/c1-2-3-12-23-21(26)25-14-17(15-8-4-6-10-19(15)22)18-13-24-20-11-7-5-9-16(18)20/h4-11,13,17,24H,2-3,12,14H2,1H3,(H2,23,25,26)