N-(3-methyl-1-oxidanylidene-1-piperidin-1-yl-butan-2-yl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-(3-methyl-1-oxidanylidene-1-piperidin-1-yl-butan-2-yl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[2-methyl-1-(piperidine-1-carbonyl)propyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[3-methyl-1-oxo-1-(1-piperidinyl)butan-2-yl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-(3-methyl-1-oxo-1-piperidin-1-ylbutan-2-yl)-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[2-methyl-1-(piperidine-1-carbonyl)propyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCCCC1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

CC(C)C(C(=O)N1CCCCC1)NC(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C22H26N4O2S/c1-15(2)19(21(28)25-10-4-3-5-11-25)24-20(27)16-8-9-17-18(14-16)29-22(23-17)26-12-6-7-13-26/h6-9,12-15,19H,3-5,10-11H2,1-2H3,(H,24,27)