1-(5-tert-butyl-2-methylsulfanyl-pyridin-3-yl)-3-[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]urea

Systemtic Name: 1-(5-tert-butyl-2-methylsulfanyl-pyridin-3-yl)-3-[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]urea Openeye Name: 1-(5-tert-butyl-2-methylsulfanyl-3-pyridyl)-3-[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]urea CAS Name: 1-[5-tert-butyl-2-(methylthio)-3-pyridinyl]-3-[4-[6-(4-morpholinylmethyl)-3-pyridinyl]-1-naphthalenyl]urea IUPAC Name: 1-(5-tert-butyl-2-methylsulfanylpyridin-3-yl)-3-[4-[6-(morpholin-4-ylmethyl)pyridin-3-yl]naphthalen-1-yl]urea Traditional Name: 1-[5-tert-butyl-2-(methylthio)-3-pyridyl]-3-[4-[6-(morpholinomethyl)-3-pyridyl]-1-naphthyl]urea Formula: C31H35N5O2S MolecularWeight: 541.7069

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(N=C1)SC)NC(=O)NC2=CC=C(C3=CC=CC=C32)C4=CN=C(C=C4)CN5CCOCC5

Isomeric SMILES

CC(C)(C)C1=CC(=C(N=C1)SC)NC(=O)NC2=CC=C(C3=CC=CC=C32)C4=CN=C(C=C4)CN5CCOCC5

InChI

InChI=1S/C31H35N5O2S/c1-31(2,3)22-17-28(29(39-4)33-19-22)35-30(37)34-27-12-11-24(25-7-5-6-8-26(25)27)21-9-10-23(32-18-21)20-36-13-15-38-16-14-36/h5-12,17-19H,13-16,20H2,1-4H3,(H2,34,35,37)