1-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylamino]-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylamino]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[(4-chloro-3-morpholinosulfonyl-benzoyl)amino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[[[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(4-chloro-3-morpholin-4-ylsulfonylbenzoyl)amino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[(4-chloro-3-morpholinosulfonyl-benzoyl)amino]-3-p-anisyl-thiourea Formula: C20H23ClN4O5S2 MolecularWeight: 499.00342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H23ClN4O5S2/c1-29-16-5-2-14(3-6-16)13-22-20(31)24-23-19(26)15-4-7-17(21)18(12-15)32(27,28)25-8-10-30-11-9-25/h2-7,12H,8-11,13H2,1H3,(H,23,26)(H2,22,24,31)