4-chloranyl-N-methyl-N-(N-oxidanylidenecarbamimidoyl)-6-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]-1H-indole-2-carboxamide

Systemtic Name: 4-chloranyl-N-methyl-N-(N-oxidanylidenecarbamimidoyl)-6-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]-1H-indole-2-carboxamide Openeye Name: 4-chloro-N-methyl-N-(N-oxocarbamimidoyl)-6-[5-(pyrrolidin-1-ylmethyl)-2-thienyl]-1H-indole-2-carboxamide CAS Name: 4-chloro-N-[imino(nitroso)methyl]-N-methyl-6-[5-(1-pyrrolidinylmethyl)-2-thiophenyl]-1H-indole-2-carboxamide IUPAC Name: 4-chloro-N-methyl-N-(N-oxocarbamimidoyl)-6-[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]-1H-indole-2-carboxamide Traditional Name: 4-chloro-N-(N-ketoamidino)-N-methyl-6-[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(N1)C=C(C=C2Cl)C3=CC=C(S3)CN4CCCC4)C(=N)N=O

Isomeric SMILES

CN(C(=O)C1=CC2=C(N1)C=C(C=C2Cl)C3=CC=C(S3)CN4CCCC4)C(=N)N=O

InChI

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