1-[[3,5-bis(bromanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methylamino]-3-pyridin-3-yl-thiourea

Systemtic Name: 1-[[3,5-bis(bromanyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methylamino]-3-pyridin-3-yl-thiourea Openeye Name: 1-[(3,5-dibromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-pyridyl)thiourea CAS Name: 1-[(3,5-dibromo-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-(3-pyridinyl)thiourea IUPAC Name: 1-[(3,5-dibromo-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-pyridin-3-ylthiourea Traditional Name: 1-[(3,5-dibromo-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(3-pyridyl)thiourea Formula: C13H10Br2N4OS MolecularWeight: 430.1177

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)NC(=S)NNC=C2C=C(C(=O)C(=C2)Br)Br

Isomeric SMILES

C1=CC(=CN=C1)NC(=S)NNC=C2C=C(C(=O)C(=C2)Br)Br

InChI

InChI=1S/C13H10Br2N4OS/c14-10-4-8(5-11(15)12(10)20)6-17-19-13(21)18-9-2-1-3-16-7-9/h1-7,17H,(H2,18,19,21)