3-[[7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanoyl]amino]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[[7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanoyl]amino]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-[[7-(5-methyl-2-thienyl)-4,7-dioxo-heptanoyl]amino]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[[7-(5-methyl-2-thiophenyl)-1,4,7-trioxoheptyl]amino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[[7-(5-methylthiophen-2-yl)-4,7-dioxoheptanoyl]amino]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-[[4,7-diketo-7-(5-methyl-2-thienyl)heptanoyl]amino]-4-pyrrolidino-benzamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)NC2=C(C=CC(=C2)C(=O)N)N3CCCC3

Isomeric SMILES

CC1=CC=C(S1)C(=O)CCC(=O)CCC(=O)NC2=C(C=CC(=C2)C(=O)N)N3CCCC3

InChI

InChI=1S/C23H27N3O4S/c1-15-4-10-21(31-15)20(28)9-6-17(27)7-11-22(29)25-18-14-16(23(24)30)5-8-19(18)26-12-2-3-13-26/h4-5,8,10,14H,2-3,6-7,9,11-13H2,1H3,(H2,24,30)(H,25,29)