N-[(Z)-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(Z)-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methylideneamino]-1H-pyrazole-5-carboxamide Openeye Name: N-[(Z)-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxy-phenyl]methyleneamino]-1H-pyrazole-5-carboxamide CAS Name: N-[(Z)-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxyphenyl]methylideneamino]-1H-pyrazole-5-carboxamide IUPAC Name: N-[(Z)-[3-(1,3-benzothiazol-2-ylsulfanylmethyl)-4-methoxyphenyl]methylideneamino]-1H-pyrazole-5-carboxamide Traditional Name: N-[(Z)-[3-[(1,3-benzothiazol-2-ylthio)methyl]-4-methoxy-benzylidene]amino]-1H-pyrazole-5-carboxamide Formula: C20H17N5O2S2 MolecularWeight: 423.51128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)C2=CC=NN2)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N\NC(=O)C2=CC=NN2)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17N5O2S2/c1-27-17-7-6-13(11-22-25-19(26)16-8-9-21-24-16)10-14(17)12-28-20-23-15-4-2-3-5-18(15)29-20/h2-11H,12H2,1H3,(H,21,24)(H,25,26)/b22-11-