methyl N-(7-methyl-4-propan-2-yl-6-thiocyanato-1,3-benzothiazol-2-yl)carbamate

Systemtic Name: methyl N-(7-methyl-4-propan-2-yl-6-thiocyanato-1,3-benzothiazol-2-yl)carbamate Openeye Name: methyl N-(4-isopropyl-7-methyl-6-thiocyanato-1,3-benzothiazol-2-yl)carbamate CAS Name: N-(7-methyl-4-propan-2-yl-6-thiocyanato-1,3-benzothiazol-2-yl)carbamic acid methyl ester IUPAC Name: methyl N-(7-methyl-4-propan-2-yl-6-thiocyanato-1,3-benzothiazol-2-yl)carbamate Traditional Name: N-(4-isopropyl-7-methyl-6-thiocyanato-1,3-benzothiazol-2-yl)carbamic acid methyl ester Formula: C14H15N3O2S2 MolecularWeight: 321.4178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C2=C1SC(=N2)NC(=O)OC)C(C)C)SC#N

Isomeric SMILES

CC1=C(C=C(C2=C1SC(=N2)NC(=O)OC)C(C)C)SC#N

InChI

InChI=1S/C14H15N3O2S2/c1-7(2)9-5-10(20-6-15)8(3)12-11(9)16-13(21-12)17-14(18)19-4/h5,7H,1-4H3,(H,16,17,18)