N-[2-[3-(1,3-benzothiazol-2-yl)propylamino]-2-oxidanylidene-ethyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[2-[3-(1,3-benzothiazol-2-yl)propylamino]-2-oxidanylidene-ethyl]-3,5-dimethyl-benzamide Openeye Name: N-[2-[3-(1,3-benzothiazol-2-yl)propylamino]-2-oxo-ethyl]-3,5-dimethyl-benzamide CAS Name: N-[2-[3-(1,3-benzothiazol-2-yl)propylamino]-2-oxoethyl]-3,5-dimethylbenzamide IUPAC Name: N-[2-[3-(1,3-benzothiazol-2-yl)propylamino]-2-oxoethyl]-3,5-dimethylbenzamide Traditional Name: N-[2-[3-(1,3-benzothiazol-2-yl)propylamino]-2-keto-ethyl]-3,5-dimethyl-benzamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCCCC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCC(=O)NCCCC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C21H23N3O2S/c1-14-10-15(2)12-16(11-14)21(26)23-13-19(25)22-9-5-8-20-24-17-6-3-4-7-18(17)27-20/h3-4,6-7,10-12H,5,8-9,13H2,1-2H3,(H,22,25)(H,23,26)