1-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-[(E)-(5-bromo-2-methoxy-phenyl)methyleneamino]-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-[(E)-(5-bromo-2-methoxy-benzylidene)amino]-3-(4-morpholinosulfonylphenyl)thiourea Formula: C19H21BrN4O4S2 MolecularWeight: 513.42844

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=N/NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C19H21BrN4O4S2/c1-27-18-7-2-15(20)12-14(18)13-21-23-19(29)22-16-3-5-17(6-4-16)30(25,26)24-8-10-28-11-9-24/h2-7,12-13H,8-11H2,1H3,(H2,22,23,29)/b21-13+