1-[(E)-[4-(4-methylphenyl)sulfonyl-5-morpholin-4-yl-1,3-oxazol-2-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[4-(4-methylphenyl)sulfonyl-5-morpholin-4-yl-1,3-oxazol-2-yl]methylideneamino]thiourea Openeye Name: [(E)-[5-morpholino-4-(p-tolylsulfonyl)oxazol-2-yl]methyleneamino]thiourea CAS Name: [(E)-[4-(4-methylphenyl)sulfonyl-5-(4-morpholinyl)-2-oxazolyl]methylideneamino]thiourea IUPAC Name: [(E)-[4-(4-methylphenyl)sulfonyl-5-morpholin-4-yl-1,3-oxazol-2-yl]methylideneamino]thiourea Traditional Name: [(E)-(5-morpholino-4-tosyl-oxazol-2-yl)methyleneamino]thiourea Formula: C16H19N5O4S2 MolecularWeight: 409.48316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)C=NNC(=S)N)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(OC(=N2)/C=N/NC(=S)N)N3CCOCC3

InChI

InChI=1S/C16H19N5O4S2/c1-11-2-4-12(5-3-11)27(22,23)14-15(21-6-8-24-9-7-21)25-13(19-14)10-18-20-16(17)26/h2-5,10H,6-9H2,1H3,(H3,17,20,26)/b18-10+