N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide

Systemtic Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Openeye Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidyl)sulfonyl]-N-(2-pyrazol-1-ylethyl)benzamide CAS Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidinyl)sulfonyl]-N-[2-(1-pyrazolyl)ethyl]benzamide IUPAC Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Traditional Name: N-(4-ethoxy-1,3-benzothiazol-2-yl)-4-(3-methylpiperidino)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Formula: C27H31N5O4S2 MolecularWeight: 553.69614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC=C1)SC(=N2)N(CCN3C=CC=N3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC(C5)C

Isomeric SMILES

CCOC1=C2C(=CC=C1)SC(=N2)N(CCN3C=CC=N3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC(C5)C

InChI

InChI=1S/C27H31N5O4S2/c1-3-36-23-8-4-9-24-25(23)29-27(37-24)32(18-17-30-15-6-14-28-30)26(33)21-10-12-22(13-11-21)38(34,35)31-16-5-7-20(2)19-31/h4,6,8-15,20H,3,5,7,16-19H2,1-2H3