4-chloranyl-N-[[5-(3-phenylpropyl)thiophen-2-yl]-piperazin-1-ylsulfonyl-methyl]benzamide

Systemtic Name: 4-chloranyl-N-[[5-(3-phenylpropyl)thiophen-2-yl]-piperazin-1-ylsulfonyl-methyl]benzamide Openeye Name: 4-chloro-N-[[5-(3-phenylpropyl)-2-thienyl]-piperazin-1-ylsulfonyl-methyl]benzamide CAS Name: 4-chloro-N-[[5-(3-phenylpropyl)-2-thiophenyl]-(1-piperazinylsulfonyl)methyl]benzamide IUPAC Name: 4-chloro-N-[[5-(3-phenylpropyl)thiophen-2-yl]-piperazin-1-ylsulfonylmethyl]benzamide Traditional Name: 4-chloro-N-[[5-(3-phenylpropyl)-2-thienyl]-piperazinosulfonyl-methyl]benzamide Formula: C25H28ClN3O3S2 MolecularWeight: 518.09112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)S(=O)(=O)C(C2=CC=C(S2)CCCC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1)S(=O)(=O)C(C2=CC=C(S2)CCCC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H28ClN3O3S2/c26-21-11-9-20(10-12-21)24(30)28-25(34(31,32)29-17-15-27-16-18-29)23-14-13-22(33-23)8-4-7-19-5-2-1-3-6-19/h1-3,5-6,9-14,25,27H,4,7-8,15-18H2,(H,28,30)