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

Systemtic Name: N-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)sulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide Openeye Name: N-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)sulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide CAS Name: N-(2-dimethylaminoethyl)-4-[(4-methoxyphenyl)thio]-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide IUPAC Name: N-(2-dimethylaminoethyl)-4-(4-methoxyphenyl)sulfanyl-N-(4-methyl-1,3-benzothiazol-2-yl)butanamide Traditional Name: N-(2-dimethylaminoethyl)-4-[(4-methoxyphenyl)thio]-N-(4-methyl-1,3-benzothiazol-2-yl)butyramide Formula: C23H29N3O2S2 MolecularWeight: 443.62526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CCN(C)C)C(=O)CCCSC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CCN(C)C)C(=O)CCCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C23H29N3O2S2/c1-17-7-5-8-20-22(17)24-23(30-20)26(15-14-25(2)3)21(27)9-6-16-29-19-12-10-18(28-4)11-13-19/h5,7-8,10-13H,6,9,14-16H2,1-4H3