[4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-(3-methylthiophen-2-yl)methanone

Systemtic Name: [4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-(3-methylthiophen-2-yl)methanone Openeye Name: [4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-(3-methyl-2-thienyl)methanone CAS Name: [4-[(1-methyl-2-imidazolyl)methyl]-1,4-diazepan-1-yl]-(3-methyl-2-thiophenyl)methanone IUPAC Name: [4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-(3-methylthiophen-2-yl)methanone Traditional Name: [4-[(1-methylimidazol-2-yl)methyl]-1,4-diazepan-1-yl]-(3-methyl-2-thienyl)methanone Formula: C16H22N4OS MolecularWeight: 318.43708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)N2CCCN(CC2)CC3=NC=CN3C

Isomeric SMILES

CC1=C(SC=C1)C(=O)N2CCCN(CC2)CC3=NC=CN3C

InChI

InChI=1S/C16H22N4OS/c1-13-4-11-22-15(13)16(21)20-7-3-6-19(9-10-20)12-14-17-5-8-18(14)2/h4-5,8,11H,3,6-7,9-10,12H2,1-2H3