N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-thieno[3,2-b]thiophen-5-ylcarbonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-thieno[3,2-b]thiophen-5-ylcarbonyl-1,4-diazepane-1-carboxamide Openeye Name: N-(3,5-dimethylisoxazol-4-yl)-4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepane-1-carboxamide CAS Name: N-(3,5-dimethyl-4-isoxazolyl)-4-[oxo(5-thieno[3,2-b]thiophenyl)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(3,5-dimethyl-1,2-oxazol-4-yl)-4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(3,5-dimethylisoxazol-4-yl)-4-(thieno[3,2-b]thiophene-5-carbonyl)-1,4-diazepane-1-carboxamide Formula: C18H20N4O3S2 MolecularWeight: 404.5064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)NC(=O)N2CCCN(CC2)C(=O)C3=CC4=C(S3)C=CS4

Isomeric SMILES

CC1=C(C(=NO1)C)NC(=O)N2CCCN(CC2)C(=O)C3=CC4=C(S3)C=CS4

InChI

InChI=1S/C18H20N4O3S2/c1-11-16(12(2)25-20-11)19-18(24)22-6-3-5-21(7-8-22)17(23)15-10-14-13(27-15)4-9-26-14/h4,9-10H,3,5-8H2,1-2H3,(H,19,24)