1-(phenylmethyl)sulfonyl-4-(thiophen-3-ylmethyl)-1,4-diazepane

Systemtic Name: 1-(phenylmethyl)sulfonyl-4-(thiophen-3-ylmethyl)-1,4-diazepane Openeye Name: 1-benzylsulfonyl-4-(3-thienylmethyl)-1,4-diazepane CAS Name: 1-(phenylmethyl)sulfonyl-4-(3-thiophenylmethyl)-1,4-diazepane IUPAC Name: 1-benzylsulfonyl-4-(thiophen-3-ylmethyl)-1,4-diazepane Traditional Name: 1-benzylsulfonyl-4-(3-thenyl)-1,4-diazepane Formula: C17H22N2O2S2 MolecularWeight: 350.49878

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)S(=O)(=O)CC2=CC=CC=C2)CC3=CSC=C3

Isomeric SMILES

C1CN(CCN(C1)S(=O)(=O)CC2=CC=CC=C2)CC3=CSC=C3

InChI

InChI=1S/C17H22N2O2S2/c20-23(21,15-16-5-2-1-3-6-16)19-9-4-8-18(10-11-19)13-17-7-12-22-14-17/h1-3,5-7,12,14H,4,8-11,13,15H2