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

Systemtic Name: S-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-[[[5-(1,3-benzothiazol-2-yl)-2-methylanilino]-oxomethyl]amino] ester IUPAC Name: S-[[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamoylamino] ester Formula: C25H23N3O5S2 MolecularWeight: 509.59722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)NSC(=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)NSC(=O)C4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C25H23N3O5S2/c1-14-9-10-15(23-26-17-7-5-6-8-21(17)34-23)11-18(14)27-25(30)28-35-24(29)16-12-19(31-2)22(33-4)20(13-16)32-3/h5-13H,1-4H3,(H2,27,28,30)