[4-(1,5-dimethylpyrazol-3-yl)carbonyl-1,4-diazepan-1-yl]-thieno[3,2-b]thiophen-5-yl-methanone

Systemtic Name: [4-(1,5-dimethylpyrazol-3-yl)carbonyl-1,4-diazepan-1-yl]-thieno[3,2-b]thiophen-5-yl-methanone Openeye Name: [4-(1,5-dimethylpyrazole-3-carbonyl)-1,4-diazepan-1-yl]-thieno[3,2-b]thiophen-5-yl-methanone CAS Name: [4-[(1,5-dimethyl-3-pyrazolyl)-oxomethyl]-1,4-diazepan-1-yl]-(5-thieno[3,2-b]thiophenyl)methanone IUPAC Name: [4-(1,5-dimethylpyrazole-3-carbonyl)-1,4-diazepan-1-yl]-thieno[3,2-b]thiophen-5-ylmethanone Traditional Name: [4-(1,5-dimethylpyrazole-3-carbonyl)-1,4-diazepan-1-yl]-thieno[3,2-b]thiophen-5-yl-methanone Formula: C18H20N4O2S2 MolecularWeight: 388.507

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C)C(=O)N2CCCN(CC2)C(=O)C3=CC4=C(S3)C=CS4

Isomeric SMILES

CC1=CC(=NN1C)C(=O)N2CCCN(CC2)C(=O)C3=CC4=C(S3)C=CS4

InChI

InChI=1S/C18H20N4O2S2/c1-12-10-13(19-20(12)2)17(23)21-5-3-6-22(8-7-21)18(24)16-11-15-14(26-16)4-9-25-15/h4,9-11H,3,5-8H2,1-2H3