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

Systemtic Name: 1-[1-(4-methoxy-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-phenethyl-thiourea Openeye Name: 1-[1-(4-methoxy-6-oxo-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-phenethyl-thiourea CAS Name: 1-[1-(4-methoxy-6-oxo-1-cyclohexa-2,4-dienylidene)ethylamino]-3-phenethylthiourea IUPAC Name: 1-[1-(4-methoxy-6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]-3-phenethylthiourea Traditional Name: 1-[1-(6-keto-4-methoxy-cyclohexa-2,4-dien-1-ylidene)ethylamino]-3-phenethyl-thiourea Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC(=CC1=O)OC)NNC(=S)NCCC2=CC=CC=C2

Isomeric SMILES

CC(=C1C=CC(=CC1=O)OC)NNC(=S)NCCC2=CC=CC=C2

InChI

InChI=1S/C18H21N3O2S/c1-13(16-9-8-15(23-2)12-17(16)22)20-21-18(24)19-11-10-14-6-4-3-5-7-14/h3-9,12,20H,10-11H2,1-2H3,(H2,19,21,24)