4-chloranyl-N-methyl-N-(N-oxidanylidenecarbamimidoyl)-7-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]-1H-indole-2-carboxamide

Systemtic Name: 4-chloranyl-N-methyl-N-(N-oxidanylidenecarbamimidoyl)-7-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]-1H-indole-2-carboxamide Openeye Name: 4-chloro-N-methyl-N-(N-oxocarbamimidoyl)-7-[5-(pyrrolidin-1-ylmethyl)-2-thienyl]-1H-indole-2-carboxamide CAS Name: 4-chloro-N-[imino(nitroso)methyl]-N-methyl-7-[5-(1-pyrrolidinylmethyl)-2-thiophenyl]-1H-indole-2-carboxamide IUPAC Name: 4-chloro-N-methyl-N-(N-oxocarbamimidoyl)-7-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]-1H-indole-2-carboxamide Traditional Name: 4-chloro-N-(N-ketoamidino)-N-methyl-7-[5-(pyrrolidinomethyl)-2-thienyl]-1H-indole-2-carboxamide Formula: C20H20ClN5O2S MolecularWeight: 429.9231

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1=CC2=C(C=CC(=C2N1)C3=CC=C(S3)CN4CCCC4)Cl)C(=N)N=O

Isomeric SMILES

CN(C(=O)C1=CC2=C(C=CC(=C2N1)C3=CC=C(S3)CN4CCCC4)Cl)C(=N)N=O

InChI

InChI=1S/C20H20ClN5O2S/c1-25(20(22)24-28)19(27)16-10-14-15(21)6-5-13(18(14)23-16)17-7-4-12(29-17)11-26-8-2-3-9-26/h4-7,10,22-23H,2-3,8-9,11H2,1H3