1-[[5-methoxy-6-oxidanylidene-3-(phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]methylideneamino]-3-(4-methoxyphenyl)thiourea

Systemtic Name: 1-[[5-methoxy-6-oxidanylidene-3-(phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]methylideneamino]-3-(4-methoxyphenyl)thiourea Openeye Name: 1-[[5-methoxy-6-oxo-3-(phenylhydrazono)cyclohexa-1,4-dien-1-yl]methyleneamino]-3-(4-methoxyphenyl)thiourea CAS Name: 1-[[5-methoxy-6-oxo-3-(phenylhydrazinylidene)-1-cyclohexa-1,4-dienyl]methylideneamino]-3-(4-methoxyphenyl)thiourea IUPAC Name: 1-[[5-methoxy-6-oxo-3-(phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]methylideneamino]-3-(4-methoxyphenyl)thiourea Traditional Name: 1-[[6-keto-5-methoxy-3-(phenylhydrazono)cyclohexa-1,4-dien-1-yl]methyleneamino]-3-(4-methoxyphenyl)thiourea Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)NN=CC2=CC(=NNC3=CC=CC=C3)C=C(C2=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)NN=CC2=CC(=NNC3=CC=CC=C3)C=C(C2=O)OC

InChI

InChI=1S/C22H21N5O3S/c1-29-19-10-8-16(9-11-19)24-22(31)27-23-14-15-12-18(13-20(30-2)21(15)28)26-25-17-6-4-3-5-7-17/h3-14,25H,1-2H3,(H2,24,27,31)