3-[[4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]phenyl]carbonylamino]-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-[[4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]phenyl]carbonylamino]-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-[[4-[(2-methylthiazol-4-yl)methylsulfanyl]benzoyl]amino]-4-pyrrolidin-1-yl-benzamide CAS Name: 3-[[[4-[(2-methyl-4-thiazolyl)methylthio]phenyl]-oxomethyl]amino]-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-[[4-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]benzoyl]amino]-4-pyrrolidin-1-ylbenzamide Traditional Name: 3-[[4-[(2-methylthiazol-4-yl)methylthio]benzoyl]amino]-4-pyrrolidino-benzamide Formula: C23H24N4O2S2 MolecularWeight: 452.59226

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)N)N4CCCC4

Isomeric SMILES

CC1=NC(=CS1)CSC2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)C(=O)N)N4CCCC4

InChI

InChI=1S/C23H24N4O2S2/c1-15-25-18(13-30-15)14-31-19-7-4-16(5-8-19)23(29)26-20-12-17(22(24)28)6-9-21(20)27-10-2-3-11-27/h4-9,12-13H,2-3,10-11,14H2,1H3,(H2,24,28)(H,26,29)