N-(1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(3-morpholinopropyl)propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-[(4-methoxyphenyl)thio]-N-[3-(4-morpholinyl)propyl]propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-(4-methoxyphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-[(4-methoxyphenyl)thio]-N-(3-morpholinopropyl)propionamide Formula: C24H29N3O3S2 MolecularWeight: 471.63536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SCCC(=O)N(CCCN2CCOCC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)SCCC(=O)N(CCCN2CCOCC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H29N3O3S2/c1-29-19-7-9-20(10-8-19)31-18-11-23(28)27(13-4-12-26-14-16-30-17-15-26)24-25-21-5-2-3-6-22(21)32-24/h2-3,5-10H,4,11-18H2,1H3