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

Systemtic Name: S-[[3-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-[[3-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-[[[3-(1,3-benzoxazol-2-yl)-2-methylanilino]-oxomethyl]amino] ester IUPAC Name: S-[[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-[[3-(1,3-benzoxazol-2-yl)-2-methyl-phenyl]carbamoylamino] ester Formula: C25H23N3O6S MolecularWeight: 493.53162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)NSC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)NSC(=O)C2=CC(=C(C(=C2)OC)OC)OC)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C25H23N3O6S/c1-14-16(23-26-18-9-5-6-11-19(18)34-23)8-7-10-17(14)27-25(30)28-35-24(29)15-12-20(31-2)22(33-4)21(13-15)32-3/h5-13H,1-4H3,(H2,27,28,30)