1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-[6-[(1-oxidanylidenethian-4-yl)amino]pyridin-3-yl]naphthalen-1-yl]urea

Systemtic Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-[6-[(1-oxidanylidenethian-4-yl)amino]pyridin-3-yl]naphthalen-1-yl]urea Openeye Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-[6-[(1-oxothian-4-yl)amino]-3-pyridyl]-1-naphthyl]urea CAS Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-[4-[6-[(1-oxo-4-thianyl)amino]-3-pyridinyl]-1-naphthalenyl]urea IUPAC Name: 1-(5-tert-butyl-2-methoxyphenyl)-3-[4-[6-[(1-oxothian-4-yl)amino]pyridin-3-yl]naphthalen-1-yl]urea Traditional Name: 1-(5-tert-butyl-2-methoxy-phenyl)-3-[4-[6-[(1-ketothian-4-yl)amino]-3-pyridyl]-1-naphthyl]urea Formula: C32H36N4O3S MolecularWeight: 556.71824

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)C4=CN=C(C=C4)NC5CCS(=O)CC5

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)NC2=CC=C(C3=CC=CC=C32)C4=CN=C(C=C4)NC5CCS(=O)CC5

InChI

InChI=1S/C32H36N4O3S/c1-32(2,3)22-10-13-29(39-4)28(19-22)36-31(37)35-27-12-11-24(25-7-5-6-8-26(25)27)21-9-14-30(33-20-21)34-23-15-17-40(38)18-16-23/h5-14,19-20,23H,15-18H2,1-4H3,(H,33,34)(H2,35,36,37)