1-[4-[[3,5-bis(iodanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]phenyl]thiourea

Systemtic Name: 1-[4-[[3,5-bis(iodanyl)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]phenyl]thiourea Openeye Name: [4-[(3,5-diiodo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea CAS Name: [4-[(3,5-diiodo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenyl]thiourea IUPAC Name: [4-[(3,5-diiodo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea Traditional Name: [4-[(3,5-diiodo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea Formula: C14H11I2N3OS MolecularWeight: 523.13058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC=C2C=C(C=C(C2=O)I)I)NC(=S)N

Isomeric SMILES

C1=CC(=CC=C1NC=C2C=C(C=C(C2=O)I)I)NC(=S)N

InChI

InChI=1S/C14H11I2N3OS/c15-9-5-8(13(20)12(16)6-9)7-18-10-1-3-11(4-2-10)19-14(17)21/h1-7,18H,(H3,17,19,21)