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

Systemtic Name: 3-tert-butyl-1-[2-(5-chloranyl-2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-2-ylmethyl)thiourea Openeye Name: 3-tert-butyl-1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-1-(2-pyridylmethyl)thiourea CAS Name: 3-tert-butyl-1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-1-(2-pyridinylmethyl)thiourea IUPAC Name: 3-tert-butyl-1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-1-(pyridin-2-ylmethyl)thiourea Traditional Name: 3-tert-butyl-1-[2-(5-chloro-2-methyl-1H-indol-3-yl)ethyl]-1-(2-pyridylmethyl)thiourea Formula: C22H27ClN4S MolecularWeight: 414.99458

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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)NC(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN4S/c1-15-18(19-13-16(23)8-9-20(19)25-15)10-12-27(21(28)26-22(2,3)4)14-17-7-5-6-11-24-17/h5-9,11,13,25H,10,12,14H2,1-4H3,(H,26,28)