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

Systemtic Name: 1-[2-(5-chloranyl-2-methyl-1H-indol-3-yl)ethyl]-3-(phenylmethyl)-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-benzyl-1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-1-(2-pyridylmethyl)thiourea CAS Name: 1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-3-(phenylmethyl)-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-benzyl-1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-benzyl-1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-1-(2-pyridylmethyl)thiourea Formula: C25H25ClN4S MolecularWeight: 449.0108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1)C=CC(=C2)Cl)CCN(CC3=CC=CC=N3)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C2=C(N1)C=CC(=C2)Cl)CCN(CC3=CC=CC=N3)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C25H25ClN4S/c1-18-22(23-15-20(26)10-11-24(23)29-18)12-14-30(17-21-9-5-6-13-27-21)25(31)28-16-19-7-3-2-4-8-19/h2-11,13,15,29H,12,14,16-17H2,1H3,(H,28,31)