N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(6-chloranyl-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(6-chloro-4-methyl-1,3-benzothiazol-2-yl)-N-(2-dimethylaminoethyl)-4-[(4-methoxyphenyl)thio]butyramide Formula: C23H28ClN3O2S2 MolecularWeight: 478.07032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)N(CCN(C)C)C(=O)CCCSC3=CC=C(C=C3)OC)Cl

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)N(CCN(C)C)C(=O)CCCSC3=CC=C(C=C3)OC)Cl

InChI

InChI=1S/C23H28ClN3O2S2/c1-16-14-17(24)15-20-22(16)25-23(31-20)27(12-11-26(2)3)21(28)6-5-13-30-19-9-7-18(29-4)8-10-19/h7-10,14-15H,5-6,11-13H2,1-4H3