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

Systemtic Name: 1-[1-(3-fluoranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(3-methylbutyl)thiourea Openeye Name: 1-[1-(3-fluoro-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-isopentyl-thiourea CAS Name: 1-[1-(3-fluoro-6-oxo-1-cyclohexa-2,4-dienylidene)ethylamino]-3-(3-methylbutyl)thiourea IUPAC Name: 1-[1-(3-fluoro-6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(3-methylbutyl)thiourea Traditional Name: 1-[1-(3-fluoro-6-keto-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-isoamyl-thiourea Formula: C14H20FN3OS MolecularWeight: 297.391503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=C1C=C(C=CC1=O)F)C

Isomeric SMILES

CC(C)CCNC(=S)NNC(=C1C=C(C=CC1=O)F)C

InChI

InChI=1S/C14H20FN3OS/c1-9(2)6-7-16-14(20)18-17-10(3)12-8-11(15)4-5-13(12)19/h4-5,8-9,17H,6-7H2,1-3H3,(H2,16,18,20)