N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-4-methoxy-3-[(2-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-4-methoxy-3-[(2-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-4-methoxy-3-(2-methylpiperidino)sulfonyl-benzamide Formula: C20H26N4O5S3 MolecularWeight: 498.63924

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=NC(=C(S3)SCC(=O)N)C)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=NC(=C(S3)SCC(=O)N)C)OC

InChI

InChI=1S/C20H26N4O5S3/c1-12-6-4-5-9-24(12)32(27,28)16-10-14(7-8-15(16)29-3)18(26)23-20-22-13(2)19(31-20)30-11-17(21)25/h7-8,10,12H,4-6,9,11H2,1-3H3,(H2,21,25)(H,22,23,26)