N-(6-acetamido-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonyl-thiophene-2-carboxamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-(1-piperidylsulfonyl)thiophene-2-carboxamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-(1-piperidinylsulfonyl)-2-thiophenecarboxamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-piperidin-1-ylsulfonylthiophene-2-carboxamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-3-piperidinosulfonyl-thiophene-2-carboxamide Formula: C19H20N4O4S3 MolecularWeight: 464.5815

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CS3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C19H20N4O4S3/c1-12(24)20-13-5-6-14-15(11-13)29-19(21-14)22-18(25)17-16(7-10-28-17)30(26,27)23-8-3-2-4-9-23/h5-7,10-11H,2-4,8-9H2,1H3,(H,20,24)(H,21,22,25)