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

Systemtic Name: S-[[5-(1,3-benzoxazol-2-yl)-2-chloranyl-phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-[[5-(1,3-benzoxazol-2-yl)-2-chloro-phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-[[[5-(1,3-benzoxazol-2-yl)-2-chloroanilino]-oxomethyl]amino] ester IUPAC Name: S-[[5-(1,3-benzoxazol-2-yl)-2-chlorophenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-[[5-(1,3-benzoxazol-2-yl)-2-chloro-phenyl]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=C(C=CC(=C2)C3=NC4=CC=CC=C4O3)Cl

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)SNC(=O)NC2=C(C=CC(=C2)C3=NC4=CC=CC=C4O3)Cl

InChI

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