N-[(E)-(4-phenyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(E)-(4-phenyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(E)-[4-phenyl-2-(1-piperidyl)thiazol-5-yl]methyleneamino]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(E)-[4-phenyl-2-(1-piperidinyl)-5-thiazolyl]methylideneamino]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(E)-(4-phenyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methylideneamino]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(E)-(4-phenyl-2-piperidino-thiazol-5-yl)methyleneamino]-3-pyrrolidinosulfonyl-benzamide Formula: C26H29N5O3S2 MolecularWeight: 523.67016

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=C(S2)C=NNC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)C2=NC(=C(S2)/C=N/NC(=O)C3=CC(=CC=C3)S(=O)(=O)N4CCCC4)C5=CC=CC=C5

InChI

InChI=1S/C26H29N5O3S2/c32-25(21-12-9-13-22(18-21)36(33,34)31-16-7-8-17-31)29-27-19-23-24(20-10-3-1-4-11-20)28-26(35-23)30-14-5-2-6-15-30/h1,3-4,9-13,18-19H,2,5-8,14-17H2,(H,29,32)/b27-19+