1-(2-phenylethenylsulfonyl)-4-(thiophen-3-ylmethyl)-1,4-diazepane

Systemtic Name: 1-(2-phenylethenylsulfonyl)-4-(thiophen-3-ylmethyl)-1,4-diazepane Openeye Name: 1-styrylsulfonyl-4-(3-thienylmethyl)-1,4-diazepane CAS Name: 1-(2-phenylethenylsulfonyl)-4-(3-thiophenylmethyl)-1,4-diazepane IUPAC Name: 1-(2-phenylethenylsulfonyl)-4-(thiophen-3-ylmethyl)-1,4-diazepane Traditional Name: 1-styrylsulfonyl-4-(3-thenyl)-1,4-diazepane Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O2S2/c21-24(22,14-8-17-5-2-1-3-6-17)20-10-4-9-19(11-12-20)15-18-7-13-23-16-18/h1-3,5-8,13-14,16H,4,9-12,15H2