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

Systemtic Name: 1-butyl-3-[2-(1H-indol-3-yl)-2-phenyl-ethyl]thiourea Openeye Name: 1-butyl-3-[2-(1H-indol-3-yl)-2-phenyl-ethyl]thiourea CAS Name: 1-butyl-3-[2-(1H-indol-3-yl)-2-phenylethyl]thiourea IUPAC Name: 1-butyl-3-[2-(1H-indol-3-yl)-2-phenylethyl]thiourea Traditional Name: 1-butyl-3-[2-(1H-indol-3-yl)-2-phenyl-ethyl]thiourea Formula: C21H25N3S MolecularWeight: 351.5083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N3S/c1-2-3-13-22-21(25)24-14-18(16-9-5-4-6-10-16)19-15-23-20-12-8-7-11-17(19)20/h4-12,15,18,23H,2-3,13-14H2,1H3,(H2,22,24,25)