2-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]amino]-N-[(4-methoxyphenyl)methyl]propanamide

Systemtic Name: 2-[[4-(1,3-benzothiazol-2-ylmethyl)phenyl]amino]-N-[(4-methoxyphenyl)methyl]propanamide Openeye Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-N-[(4-methoxyphenyl)methyl]propanamide CAS Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-N-[(4-methoxyphenyl)methyl]propanamide IUPAC Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-N-[(4-methoxyphenyl)methyl]propanamide Traditional Name: 2-[4-(1,3-benzothiazol-2-ylmethyl)anilino]-N-p-anisyl-propionamide Formula: C25H25N3O2S MolecularWeight: 431.5499

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)OC)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)OC)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H25N3O2S/c1-17(25(29)26-16-19-9-13-21(30-2)14-10-19)27-20-11-7-18(8-12-20)15-24-28-22-5-3-4-6-23(22)31-24/h3-14,17,27H,15-16H2,1-2H3,(H,26,29)