1-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-(phenylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-(phenylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-benzyl-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(3-pyridylmethyl)thiourea CAS Name: 1-[2-(2-methyl-1H-indol-3-yl)ethyl]-3-(phenylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-benzyl-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-benzyl-1-[2-(2-methyl-1H-indol-3-yl)ethyl]-1-(3-pyridylmethyl)thiourea Formula: C25H26N4S MolecularWeight: 414.56574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)CCN(CC3=CN=CC=C3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)CCN(CC3=CN=CC=C3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C25H26N4S/c1-19-22(23-11-5-6-12-24(23)28-19)13-15-29(18-21-10-7-14-26-16-21)25(30)27-17-20-8-3-2-4-9-20/h2-12,14,16,28H,13,15,17-18H2,1H3,(H,27,30)