N-(4-fluorophenyl)sulfonyl-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(4-fluorophenyl)sulfonyl-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carboxamide Openeye Name: N-(4-fluorophenyl)sulfonyl-4-(3-thienylmethyl)-1,4-diazepane-1-carboxamide CAS Name: N-(4-fluorophenyl)sulfonyl-4-(3-thiophenylmethyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-(4-fluorophenyl)sulfonyl-4-(thiophen-3-ylmethyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(4-fluorophenyl)sulfonyl-4-(3-thenyl)-1,4-diazepane-1-carboxamide Formula: C17H20FN3O3S2 MolecularWeight: 397.487403

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)F)CC3=CSC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)F)CC3=CSC=C3

InChI

InChI=1S/C17H20FN3O3S2/c18-15-2-4-16(5-3-15)26(23,24)19-17(22)21-8-1-7-20(9-10-21)12-14-6-11-25-13-14/h2-6,11,13H,1,7-10,12H2,(H,19,22)