1-[(Z)-[5-bromanyl-1-[(E)-3-chloranylbut-2-enyl]-2-oxidanylidene-indol-3-ylidene]amino]thiourea

Systemtic Name: 1-[(Z)-[5-bromanyl-1-[(E)-3-chloranylbut-2-enyl]-2-oxidanylidene-indol-3-ylidene]amino]thiourea Openeye Name: [(Z)-[5-bromo-1-[(E)-3-chlorobut-2-enyl]-2-oxo-indolin-3-ylidene]amino]thiourea CAS Name: [(Z)-[5-bromo-1-[(E)-3-chlorobut-2-enyl]-2-oxo-3-indolylidene]amino]thiourea IUPAC Name: [(Z)-[5-bromo-1-[(E)-3-chlorobut-2-enyl]-2-oxoindol-3-ylidene]amino]thiourea Traditional Name: [(Z)-[5-bromo-1-[(E)-3-chlorobut-2-enyl]-2-keto-indolin-3-ylidene]amino]thiourea Formula: C13H12BrClN4OS MolecularWeight: 387.68258

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C2=C(C=C(C=C2)Br)C(=NNC(=S)N)C1=O)Cl

Isomeric SMILES

C/C(=C\CN1C2=C(C=C(C=C2)Br)/C(=N/NC(=S)N)/C1=O)/Cl

InChI

InChI=1S/C13H12BrClN4OS/c1-7(15)4-5-19-10-3-2-8(14)6-9(10)11(12(19)20)17-18-13(16)21/h2-4,6H,5H2,1H3,(H3,16,18,21)/b7-4+,17-11-