4-(1,3-benzothiazol-2-yl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(benzylamino)-2-oxo-ethyl]butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(benzylamino)-2-oxoethyl]butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-[2-(benzylamino)-2-keto-ethyl]butyramide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CNC(=O)CCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CNC(=O)CCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H21N3O2S/c24-18(22-14-19(25)21-13-15-7-2-1-3-8-15)11-6-12-20-23-16-9-4-5-10-17(16)26-20/h1-5,7-10H,6,11-14H2,(H,21,25)(H,22,24)