1-butyl-3-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-butyl-3-[1-(3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-butyl-3-[1-(3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-butyl-3-[1-(3-methyl-6-oxo-1-cyclohexa-2,4-dienylidene)ethylamino]thiourea IUPAC Name: 1-butyl-3-[1-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-butyl-3-[1-(6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Formula: C14H21N3OS MolecularWeight: 279.40104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=C1C=C(C=CC1=O)C)C

Isomeric SMILES

CCCCNC(=S)NNC(=C1C=C(C=CC1=O)C)C

InChI

InChI=1S/C14H21N3OS/c1-4-5-8-15-14(19)17-16-11(3)12-9-10(2)6-7-13(12)18/h6-7,9,16H,4-5,8H2,1-3H3,(H2,15,17,19)