5-chloranyl-N-[[3-[4-(N-methyl-N-prop-2-ynyl-carbamimidoyl)phenyl]-1,2-oxazol-5-yl]methyl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[[3-[4-(N-methyl-N-prop-2-ynyl-carbamimidoyl)phenyl]-1,2-oxazol-5-yl]methyl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[[3-[4-(N-methyl-N-prop-2-ynyl-carbamimidoyl)phenyl]isoxazol-5-yl]methyl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[[3-[4-[imino-[methyl(prop-2-ynyl)amino]methyl]phenyl]-5-isoxazolyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[[3-[4-(N-methyl-N-prop-2-ynylcarbamimidoyl)phenyl]-1,2-oxazol-5-yl]methyl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[[3-[4-(N-methyl-N-propargyl-amidino)phenyl]isoxazol-5-yl]methyl]thiophene-2-carboxamide Formula: C20H17ClN4O2S MolecularWeight: 412.89258

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#C)C(=N)C1=CC=C(C=C1)C2=NOC(=C2)CNC(=O)C3=CC=C(S3)Cl

Isomeric SMILES

CN(CC#C)C(=N)C1=CC=C(C=C1)C2=NOC(=C2)CNC(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C20H17ClN4O2S/c1-3-10-25(2)19(22)14-6-4-13(5-7-14)16-11-15(27-24-16)12-23-20(26)17-8-9-18(21)28-17/h1,4-9,11,22H,10,12H2,2H3,(H,23,26)