1-[(E)-[3-bromanyl-5-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methylideneamino]-3-methylsulfanyl-urea

Systemtic Name: 1-[(E)-[3-bromanyl-5-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methylideneamino]-3-methylsulfanyl-urea Openeye Name: 1-[(E)-[3-bromo-5-methoxy-4-(4-pyridylmethoxy)phenyl]methyleneamino]-3-methylsulfanyl-urea CAS Name: 1-[(E)-[3-bromo-5-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methylideneamino]-3-(methylthio)urea IUPAC Name: 1-[(E)-[3-bromo-5-methoxy-4-(pyridin-4-ylmethoxy)phenyl]methylideneamino]-3-methylsulfanylurea Traditional Name: 1-[(E)-[3-bromo-5-methoxy-4-(4-pyridylmethoxy)benzylidene]amino]-3-(methylthio)urea Formula: C16H17BrN4O3S MolecularWeight: 425.30018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=O)NSC)Br)OCC2=CC=NC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=O)NSC)Br)OCC2=CC=NC=C2

InChI

InChI=1S/C16H17BrN4O3S/c1-23-14-8-12(9-19-20-16(22)21-25-2)7-13(17)15(14)24-10-11-3-5-18-6-4-11/h3-9H,10H2,1-2H3,(H2,20,21,22)/b19-9+