N-(2-dimethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfanyl-butanamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfanyl-butanamide Openeye Name: N-(2-dimethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfanyl-butanamide CAS Name: N-(2-dimethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-[(4-methoxyphenyl)thio]butanamide IUPAC Name: N-(2-dimethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-(4-methoxyphenyl)sulfanylbutanamide Traditional Name: N-(2-dimethylaminoethyl)-N-(4-ethyl-1,3-benzothiazol-2-yl)-4-[(4-methoxyphenyl)thio]butyramide Formula: C24H31N3O2S2 MolecularWeight: 457.65184

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N(CCN(C)C)C(=O)CCCSC3=CC=C(C=C3)OC

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N(CCN(C)C)C(=O)CCCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C24H31N3O2S2/c1-5-18-8-6-9-21-23(18)25-24(31-21)27(16-15-26(2)3)22(28)10-7-17-30-20-13-11-19(29-4)12-14-20/h6,8-9,11-14H,5,7,10,15-17H2,1-4H3