(4-methylsulfonyl-1,4-diazepan-1-yl)-(3-methylthiophen-2-yl)methanone

Systemtic Name: (4-methylsulfonyl-1,4-diazepan-1-yl)-(3-methylthiophen-2-yl)methanone Openeye Name: (4-methylsulfonyl-1,4-diazepan-1-yl)-(3-methyl-2-thienyl)methanone CAS Name: (4-methylsulfonyl-1,4-diazepan-1-yl)-(3-methyl-2-thiophenyl)methanone IUPAC Name: (4-methylsulfonyl-1,4-diazepan-1-yl)-(3-methylthiophen-2-yl)methanone Traditional Name: (4-mesyl-1,4-diazepan-1-yl)-(3-methyl-2-thienyl)methanone Formula: C12H18N2O3S2 MolecularWeight: 302.41292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N2CCCN(CC2)S(=O)(=O)C

Isomeric SMILES

CC1=C(SC=C1)C(=O)N2CCCN(CC2)S(=O)(=O)C

InChI

InChI=1S/C12H18N2O3S2/c1-10-4-9-18-11(10)12(15)13-5-3-6-14(8-7-13)19(2,16)17/h4,9H,3,5-8H2,1-2H3