1-[(Z)-[2-butyl-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]amino]thiourea

Systemtic Name: 1-[(Z)-[2-butyl-1,3-bis(oxidanylidene)isoquinolin-4-ylidene]amino]thiourea Openeye Name: [(Z)-(2-butyl-1,3-dioxo-4-isoquinolylidene)amino]thiourea CAS Name: [(Z)-(2-butyl-1,3-dioxo-4-isoquinolinylidene)amino]thiourea IUPAC Name: [(Z)-(2-butyl-1,3-dioxoisoquinolin-4-ylidene)amino]thiourea Traditional Name: [(Z)-(2-butyl-1,3-diketo-4-isoquinolylidene)amino]thiourea Formula: C14H16N4O2S MolecularWeight: 304.36744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=NNC(=S)N)C1=O

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2/C(=N/NC(=S)N)/C1=O

InChI

InChI=1S/C14H16N4O2S/c1-2-3-8-18-12(19)10-7-5-4-6-9(10)11(13(18)20)16-17-14(15)21/h4-7H,2-3,8H2,1H3,(H3,15,17,21)/b16-11-