1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]-3-(phenylmethyl)-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]-3-(phenylmethyl)-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-benzyl-1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]-1-(3-pyridylmethyl)thiourea CAS Name: 1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]-3-(phenylmethyl)-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-benzyl-1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-benzyl-1-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]-1-(3-pyridylmethyl)thiourea Formula: C26H28N4OS MolecularWeight: 444.59172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)OC)CCN(CC3=CN=CC=C3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)OC)CCN(CC3=CN=CC=C3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C26H28N4OS/c1-19-23(24-15-22(31-2)10-11-25(24)29-19)12-14-30(18-21-9-6-13-27-16-21)26(32)28-17-20-7-4-3-5-8-20/h3-11,13,15-16,29H,12,14,17-18H2,1-2H3,(H,28,32)