2-azanyl-N-[(E)-(3-methoxy-4-phenethyloxy-phenyl)methylideneamino]-4-methyl-1,3-thiazole-5-carboxamide

Systemtic Name: 2-azanyl-N-[(E)-(3-methoxy-4-phenethyloxy-phenyl)methylideneamino]-4-methyl-1,3-thiazole-5-carboxamide Openeye Name: 2-amino-N-[(E)-(3-methoxy-4-phenethyloxy-phenyl)methyleneamino]-4-methyl-thiazole-5-carboxamide CAS Name: 2-amino-N-[(E)-(3-methoxy-4-phenethyloxyphenyl)methylideneamino]-4-methyl-5-thiazolecarboxamide IUPAC Name: 2-amino-N-[(E)-(3-methoxy-4-phenethyloxyphenyl)methylideneamino]-4-methyl-1,3-thiazole-5-carboxamide Traditional Name: 2-amino-N-[(E)-(3-methoxy-4-phenethyloxy-benzylidene)amino]-4-methyl-thiazole-5-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N)C(=O)NN=CC2=CC(=C(C=C2)OCCC3=CC=CC=C3)OC

Isomeric SMILES

CC1=C(SC(=N1)N)C(=O)N/N=C/C2=CC(=C(C=C2)OCCC3=CC=CC=C3)OC

InChI

InChI=1S/C21H22N4O3S/c1-14-19(29-21(22)24-14)20(26)25-23-13-16-8-9-17(18(12-16)27-2)28-11-10-15-6-4-3-5-7-15/h3-9,12-13H,10-11H2,1-2H3,(H2,22,24)(H,25,26)/b23-13+