N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-pyrrol-1-yl-benzamide Openeye Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-pyrrol-1-yl-benzamide CAS Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-(1-pyrrolyl)benzamide IUPAC Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-pyrrol-1-ylbenzamide Traditional Name: N-[(1S)-1-(1,3-benzothiazol-2-yl)ethyl]-N-methyl-3-pyrrol-1-yl-benzamide Formula: C21H19N3OS MolecularWeight: 361.46006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC(=CC=C3)N4C=CC=C4

Isomeric SMILES

C[C@@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)C3=CC(=CC=C3)N4C=CC=C4

InChI

InChI=1S/C21H19N3OS/c1-15(20-22-18-10-3-4-11-19(18)26-20)23(2)21(25)16-8-7-9-17(14-16)24-12-5-6-13-24/h3-15H,1-2H3/t15-/m0/s1