S-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate

Systemtic Name: S-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-[[[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]amino]-oxomethyl]amino] ester IUPAC Name: S-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-[[2-(4-chlorophenyl)-1,3-benzoxazol-5-yl]carbamoylamino] ester Formula: C24H20ClN3O6S MolecularWeight: 513.9501

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)SNC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)SNC(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H20ClN3O6S/c1-31-19-10-14(11-20(32-2)21(19)33-3)23(29)35-28-24(30)26-16-8-9-18-17(12-16)27-22(34-18)13-4-6-15(25)7-5-13/h4-12H,1-3H3,(H2,26,28,30)