1-[(E)-[(3E)-6-oxidanylidene-3-(phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-[(3E)-6-oxidanylidene-3-(phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-[(3E)-6-oxo-3-(phenylhydrazono)cyclohexa-1,4-dien-1-yl]methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-[(3E)-6-oxo-3-(phenylhydrazinylidene)-1-cyclohexa-1,4-dienyl]methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-[(3E)-6-oxo-3-(phenylhydrazinylidene)cyclohexa-1,4-dien-1-yl]methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-[(3E)-6-keto-3-(phenylhydrazono)cyclohexa-1,4-dien-1-yl]methyleneamino]-3-phenyl-thiourea Formula: C20H17N5OS MolecularWeight: 375.44688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)N/N=C/C2=C/C(=N/NC3=CC=CC=C3)/C=CC2=O

InChI

InChI=1S/C20H17N5OS/c26-19-12-11-18(24-23-17-9-5-2-6-10-17)13-15(19)14-21-25-20(27)22-16-7-3-1-4-8-16/h1-14,23H,(H2,22,25,27)/b21-14+,24-18+