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

Systemtic Name: N-(4-chloranyl-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Openeye Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidyl)sulfonyl]-N-(2-pyrazol-1-ylethyl)benzamide CAS Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-[(3-methyl-1-piperidinyl)sulfonyl]-N-[2-(1-pyrazolyl)ethyl]benzamide IUPAC Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-(3-methylpiperidin-1-yl)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Traditional Name: N-(4-chloro-1,3-benzothiazol-2-yl)-4-(3-methylpiperidino)sulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Formula: C25H26ClN5O3S2 MolecularWeight: 544.08864

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN3C=CC=N3)C4=NC5=C(S4)C=CC=C5Cl

Isomeric SMILES

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N(CCN3C=CC=N3)C4=NC5=C(S4)C=CC=C5Cl

InChI

InChI=1S/C25H26ClN5O3S2/c1-18-5-3-14-30(17-18)36(33,34)20-10-8-19(9-11-20)24(32)31(16-15-29-13-4-12-27-29)25-28-23-21(26)6-2-7-22(23)35-25/h2,4,6-13,18H,3,5,14-17H2,1H3