1-[(E)-[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylideneamino]-3-methyl-thiourea

Systemtic Name: 1-[(E)-[3-bromanyl-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylideneamino]-3-methyl-thiourea Openeye Name: 1-[(E)-[3-bromo-5-methoxy-4-(2-pyridylmethoxy)phenyl]methyleneamino]-3-methyl-thiourea CAS Name: 1-[(E)-[3-bromo-5-methoxy-4-(2-pyridinylmethoxy)phenyl]methylideneamino]-3-methylthiourea IUPAC Name: 1-[(E)-[3-bromo-5-methoxy-4-(pyridin-2-ylmethoxy)phenyl]methylideneamino]-3-methylthiourea Traditional Name: 1-[(E)-[3-bromo-5-methoxy-4-(2-pyridylmethoxy)benzylidene]amino]-3-methyl-thiourea Formula: C16H17BrN4O2S MolecularWeight: 409.30078

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NN=CC1=CC(=C(C(=C1)Br)OCC2=CC=CC=N2)OC

Isomeric SMILES

CNC(=S)N/N=C/C1=CC(=C(C(=C1)Br)OCC2=CC=CC=N2)OC

InChI

InChI=1S/C16H17BrN4O2S/c1-18-16(24)21-20-9-11-7-13(17)15(14(8-11)22-2)23-10-12-5-3-4-6-19-12/h3-9H,10H2,1-2H3,(H2,18,21,24)/b20-9+