N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: N-(2-diethylaminoethyl)-3-[(4-methoxyphenyl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: N-(2-diethylaminoethyl)-3-(4-methoxyphenyl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: N-(2-diethylaminoethyl)-3-[(4-methoxyphenyl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C24H31N3O2S2 MolecularWeight: 457.65184

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)CCSC3=CC=C(C=C3)OC

Isomeric SMILES

CCN(CC)CCN(C1=NC2=C(S1)C=C(C=C2)C)C(=O)CCSC3=CC=C(C=C3)OC

InChI

InChI=1S/C24H31N3O2S2/c1-5-26(6-2)14-15-27(24-25-21-12-7-18(3)17-22(21)31-24)23(28)13-16-30-20-10-8-19(29-4)9-11-20/h7-12,17H,5-6,13-16H2,1-4H3