1-(2-methoxyethyl)-3-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]thiourea

Systemtic Name: 1-(2-methoxyethyl)-3-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]thiourea Openeye Name: 1-(2-methoxyethyl)-3-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]thiourea CAS Name: 1-(2-methoxyethyl)-3-[(Z)-1-[4-methoxy-3-[(2-pyrimidinylthio)methyl]phenyl]ethylideneamino]thiourea IUPAC Name: 1-(2-methoxyethyl)-3-[(Z)-1-[4-methoxy-3-(pyrimidin-2-ylsulfanylmethyl)phenyl]ethylideneamino]thiourea Traditional Name: 1-(2-methoxyethyl)-3-[(Z)-1-[4-methoxy-3-[(2-pyrimidylthio)methyl]phenyl]ethylideneamino]thiourea Formula: C18H23N5O2S2 MolecularWeight: 405.53752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NCCOC)C1=CC(=C(C=C1)OC)CSC2=NC=CC=N2

Isomeric SMILES

C/C(=N/NC(=S)NCCOC)/C1=CC(=C(C=C1)OC)CSC2=NC=CC=N2

InChI

InChI=1S/C18H23N5O2S2/c1-13(22-23-17(26)19-9-10-24-2)14-5-6-16(25-3)15(11-14)12-27-18-20-7-4-8-21-18/h4-8,11H,9-10,12H2,1-3H3,(H2,19,23,26)/b22-13-