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

Systemtic Name: N-[3-methyl-1-oxidanylidene-1-(3-oxidanylpropylamino)butan-2-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Openeye Name: N-[1-(3-hydroxypropylcarbamoyl)-2-methyl-propyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide CAS Name: N-[1-(3-hydroxypropylamino)-3-methyl-1-oxobutan-2-yl]-2-(1-pyrrolyl)-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[1-(3-hydroxypropylamino)-3-methyl-1-oxobutan-2-yl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Traditional Name: N-[1-(3-hydroxypropylcarbamoyl)-2-methyl-propyl]-2-pyrrol-1-yl-1,3-benzothiazole-6-carboxamide Formula: C20H24N4O3S MolecularWeight: 400.49456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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