1-(4-morpholin-4-ylsulfonylphenyl)-3-[1-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-(4-morpholin-4-ylsulfonylphenyl)-3-[1-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-(4-morpholinosulfonylphenyl)-3-[1-(6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-[4-(4-morpholinylsulfonyl)phenyl]-3-[1-(6-oxo-1-cyclohexa-2,4-dienylidene)ethylamino]thiourea IUPAC Name: 1-(4-morpholin-4-ylsulfonylphenyl)-3-[1-(6-oxocyclohexa-2,4-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-[1-(6-ketocyclohexa-2,4-dien-1-ylidene)ethylamino]-3-(4-morpholinosulfonylphenyl)thiourea Formula: C19H22N4O4S2 MolecularWeight: 434.53238

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC=CC1=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC(=C1C=CC=CC1=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H22N4O4S2/c1-14(17-4-2-3-5-18(17)24)21-22-19(28)20-15-6-8-16(9-7-15)29(25,26)23-10-12-27-13-11-23/h2-9,21H,10-13H2,1H3,(H2,20,22,28)