N-[3-[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-3-oxidanylidene-propyl]-2-methyl-benzamide

Systemtic Name: N-[3-[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-3-oxidanylidene-propyl]-2-methyl-benzamide Openeye Name: N-[3-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxo-propyl]-2-methyl-benzamide CAS Name: N-[3-[(6-methoxy-1,3-benzothiazol-2-yl)-(phenylmethyl)amino]-3-oxopropyl]-2-methylbenzamide IUPAC Name: N-[3-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-oxopropyl]-2-methylbenzamide Traditional Name: N-[3-[benzyl-(6-methoxy-1,3-benzothiazol-2-yl)amino]-3-keto-propyl]-2-methyl-benzamide Formula: C26H25N3O3S MolecularWeight: 459.56

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)N(CC2=CC=CC=C2)C3=NC4=C(S3)C=C(C=C4)OC

InChI

InChI=1S/C26H25N3O3S/c1-18-8-6-7-11-21(18)25(31)27-15-14-24(30)29(17-19-9-4-3-5-10-19)26-28-22-13-12-20(32-2)16-23(22)33-26/h3-13,16H,14-15,17H2,1-2H3,(H,27,31)