1-[[4-(diethylamino)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]-3-(2-fluorophenyl)thiourea

Systemtic Name: 1-[[4-(diethylamino)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methylamino]-3-(2-fluorophenyl)thiourea Openeye Name: 1-[[4-(diethylamino)-6-oxo-cyclohexa-2,4-dien-1-ylidene]methylamino]-3-(2-fluorophenyl)thiourea CAS Name: 1-[[4-(diethylamino)-6-oxo-1-cyclohexa-2,4-dienylidene]methylamino]-3-(2-fluorophenyl)thiourea IUPAC Name: 1-[[4-(diethylamino)-6-oxocyclohexa-2,4-dien-1-ylidene]methylamino]-3-(2-fluorophenyl)thiourea Traditional Name: 1-[[4-(diethylamino)-6-keto-cyclohexa-2,4-dien-1-ylidene]methylamino]-3-(2-fluorophenyl)thiourea Formula: C18H21FN4OS MolecularWeight: 360.448943

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=O)C(=CNNC(=S)NC2=CC=CC=C2F)C=C1

Isomeric SMILES

CCN(CC)C1=CC(=O)C(=CNNC(=S)NC2=CC=CC=C2F)C=C1

InChI

InChI=1S/C18H21FN4OS/c1-3-23(4-2)14-10-9-13(17(24)11-14)12-20-22-18(25)21-16-8-6-5-7-15(16)19/h5-12,20H,3-4H2,1-2H3,(H2,21,22,25)