1-[(3-bromanyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenyl-thiourea

Systemtic Name: 1-[(3-bromanyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenyl-thiourea Openeye Name: 1-[(3-bromo-5-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenyl-thiourea CAS Name: 1-[(3-bromo-5-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-phenylthiourea IUPAC Name: 1-[(3-bromo-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenylthiourea Traditional Name: 1-[(3-bromo-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenyl-thiourea Formula: C16H16BrN3O2S MolecularWeight: 394.28614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC(=S)NC2=CC=CC=C2)C=C(C1=O)Br

Isomeric SMILES

CCOC1=CC(=CNNC(=S)NC2=CC=CC=C2)C=C(C1=O)Br

InChI

InChI=1S/C16H16BrN3O2S/c1-2-22-14-9-11(8-13(17)15(14)21)10-18-20-16(23)19-12-6-4-3-5-7-12/h3-10,18H,2H2,1H3,(H2,19,20,23)