S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate

Systemtic Name: S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Openeye Name: S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate CAS Name: 3,4,5-trimethoxybenzenecarbothioic acid S-[[[(6-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]amino] ester IUPAC Name: S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] 3,4,5-trimethoxybenzenecarbothioate Traditional Name: 3,4,5-trimethoxythiobenzoic acid S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] ester Formula: C19H19N3O5S2 MolecularWeight: 433.50126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)NSC(=O)C3=CC(=C(C(=C3)OC)OC)OC

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)NSC(=O)C3=CC(=C(C(=C3)OC)OC)OC

InChI

InChI=1S/C19H19N3O5S2/c1-10-5-6-12-15(7-10)28-19(20-12)21-18(24)22-29-17(23)11-8-13(25-2)16(27-4)14(9-11)26-3/h5-9H,1-4H3,(H2,20,21,22,24)