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

Systemtic Name: S-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-[[[4-(1,3-benzothiazol-2-yl)anilino]-oxomethyl]amino] ester IUPAC Name: S-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-[[4-(1,3-benzothiazol-2-yl)phenyl]carbamoylamino] ester Formula: C24H21N3O5S2 MolecularWeight: 495.57064

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)SNC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)SNC(=O)NC2=CC=C(C=C2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H21N3O5S2/c1-30-18-12-15(13-19(31-2)21(18)32-3)23(28)34-27-24(29)25-16-10-8-14(9-11-16)22-26-17-6-4-5-7-20(17)33-22/h4-13H,1-3H3,(H2,25,27,29)