methyl 5-methyl-2-[(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[[(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[(6-methyl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C16H19N3O2S3 MolecularWeight: 381.53596

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=N2)NC(=S)NC3=C(C=C(S3)C)C(=O)OC

Isomeric SMILES

CC1CCC2=C(C1)SC(=N2)NC(=S)NC3=C(C=C(S3)C)C(=O)OC

InChI

InChI=1S/C16H19N3O2S3/c1-8-4-5-11-12(6-8)24-16(17-11)19-15(22)18-13-10(14(20)21-3)7-9(2)23-13/h7-8H,4-6H2,1-3H3,(H2,17,18,19,22)