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

Systemtic Name: S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] 4-methylbenzenecarbothioate Openeye Name: S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] 4-methylbenzenecarbothioate CAS Name: 4-methylbenzenecarbothioic acid S-[[[(6-methyl-1,3-benzothiazol-2-yl)amino]-oxomethyl]amino] ester IUPAC Name: S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] 4-methylbenzenecarbothioate Traditional Name: 4-methylthiobenzoic acid S-[(6-methyl-1,3-benzothiazol-2-yl)carbamoylamino] ester Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)SNC(=O)NC2=NC3=C(S2)C=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)SNC(=O)NC2=NC3=C(S2)C=C(C=C3)C

InChI

InChI=1S/C17H15N3O2S2/c1-10-3-6-12(7-4-10)15(21)24-20-16(22)19-17-18-13-8-5-11(2)9-14(13)23-17/h3-9H,1-2H3,(H2,18,19,20,22)