N-[(E)-(3-bromophenyl)methylideneamino]-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-[(E)-(3-bromophenyl)methylideneamino]-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-[(E)-(3-bromophenyl)methyleneamino]-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-[(E)-(3-bromophenyl)methylideneamino]-2-(2-pyrimidinylthio)propanamide IUPAC Name: N-[(E)-(3-bromophenyl)methylideneamino]-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-[(E)-(3-bromobenzylidene)amino]-2-(2-pyrimidylthio)propionamide Formula: C14H13BrN4OS MolecularWeight: 365.24822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN=CC1=CC(=CC=C1)Br)SC2=NC=CC=N2

Isomeric SMILES

CC(C(=O)N/N=C/C1=CC(=CC=C1)Br)SC2=NC=CC=N2

InChI

InChI=1S/C14H13BrN4OS/c1-10(21-14-16-6-3-7-17-14)13(20)19-18-9-11-4-2-5-12(15)8-11/h2-10H,1H3,(H,19,20)/b18-9+