N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-pyrrol-1-yl-benzamide Openeye Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-pyrrol-1-yl-benzamide CAS Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-(1-pyrrolyl)benzamide IUPAC Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-pyrrol-1-ylbenzamide Traditional Name: N-[1-(1,3-benzothiazol-2-yl)ethyl]-N,4-dimethyl-3-pyrrol-1-yl-benzamide Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)N4C=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N(C)C(C)C2=NC3=CC=CC=C3S2)N4C=CC=C4

InChI

InChI=1S/C22H21N3OS/c1-15-10-11-17(14-19(15)25-12-6-7-13-25)22(26)24(3)16(2)21-23-18-8-4-5-9-20(18)27-21/h4-14,16H,1-3H3