1-[[(E)-[1-hexyl-2,4-bis(oxidanylidene)quinolin-3-ylidene]methyl]amino]thiourea

Systemtic Name: 1-[[(E)-[1-hexyl-2,4-bis(oxidanylidene)quinolin-3-ylidene]methyl]amino]thiourea Openeye Name: [[(E)-(1-hexyl-2,4-dioxo-3-quinolylidene)methyl]amino]thiourea CAS Name: [[(E)-(1-hexyl-2,4-dioxo-3-quinolinylidene)methyl]amino]thiourea IUPAC Name: [[(E)-(1-hexyl-2,4-dioxoquinolin-3-ylidene)methyl]amino]thiourea Traditional Name: [[(E)-(1-hexyl-2,4-diketo-3-quinolylidene)methyl]amino]thiourea Formula: C17H22N4O2S MolecularWeight: 346.44718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C2=CC=CC=C2C(=O)C(=CNNC(=S)N)C1=O

Isomeric SMILES

CCCCCCN1C2=CC=CC=C2C(=O)/C(=C\NNC(=S)N)/C1=O

InChI

InChI=1S/C17H22N4O2S/c1-2-3-4-7-10-21-14-9-6-5-8-12(14)15(22)13(16(21)23)11-19-20-17(18)24/h5-6,8-9,11,19H,2-4,7,10H2,1H3,(H3,18,20,24)/b13-11+