5-chloranyl-N-[(1S)-1-[3-[4-(C-pyrrolidin-1-ylcarbonimidoyl)phenyl]-1,2-oxazol-5-yl]ethyl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[(1S)-1-[3-[4-(C-pyrrolidin-1-ylcarbonimidoyl)phenyl]-1,2-oxazol-5-yl]ethyl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[(1S)-1-[3-[4-(pyrrolidine-1-carboximidoyl)phenyl]isoxazol-5-yl]ethyl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[(1S)-1-[3-[4-[imino(1-pyrrolidinyl)methyl]phenyl]-5-isoxazolyl]ethyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[(1S)-1-[3-[4-(pyrrolidine-1-carboximidoyl)phenyl]-1,2-oxazol-5-yl]ethyl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[(1S)-1-[3-[4-(pyrrolidine-1-carboximidoyl)phenyl]isoxazol-5-yl]ethyl]thiophene-2-carboxamide Formula: C21H21ClN4O2S MolecularWeight: 428.93504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=NO1)C2=CC=C(C=C2)C(=N)N3CCCC3)NC(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C[C@@H](C1=CC(=NO1)C2=CC=C(C=C2)C(=N)N3CCCC3)NC(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C21H21ClN4O2S/c1-13(24-21(27)18-8-9-19(22)29-18)17-12-16(25-28-17)14-4-6-15(7-5-14)20(23)26-10-2-3-11-26/h4-9,12-13,23H,2-3,10-11H2,1H3,(H,24,27)/t13-/m0/s1