N-[1-(2-hydroxyethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[1-(2-hydroxyethylamino)-4-methyl-1-oxidanylidene-pentan-2-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[1-(2-hydroxyethylcarbamoyl)-3-methyl-butyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[1-(2-hydroxyethylamino)-4-methyl-1-oxopentan-2-yl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[1-(2-hydroxyethylamino)-4-methyl-1-oxopentan-2-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[1-(2-hydroxyethylcarbamoyl)-3-methyl-butyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCCO)NC(=O)C1=CC2=C(C=C1)N=C(S2)N3C=CC=C3

Isomeric SMILES

CC(C)CC(C(=O)NCCO)NC(=O)C1=CC2=C(C=C1)N=C(S2)N3C=CC=C3

InChI

InChI=1S/C20H24N4O3S/c1-13(2)11-16(19(27)21-7-10-25)22-18(26)14-5-6-15-17(12-14)28-20(23-15)24-8-3-4-9-24/h3-6,8-9,12-13,16,25H,7,10-11H2,1-2H3,(H,21,27)(H,22,26)