N-[bis(azanyl)methylidene]-5-chloranyl-1-(pyridin-4-ylmethyl)indole-2-carboxamide hydrochloride

Systemtic Name: N-[bis(azanyl)methylidene]-5-chloranyl-1-(pyridin-4-ylmethyl)indole-2-carboxamide hydrochloride Openeye Name: 5-chloro-N-(diaminomethylene)-1-(4-pyridylmethyl)indole-2-carboxamide hydrochloride CAS Name: 5-chloro-N-(diaminomethylidene)-1-(pyridin-4-ylmethyl)-2-indolecarboxamide hydrochloride IUPAC Name: 5-chloro-N-(diaminomethylidene)-1-(pyridin-4-ylmethyl)indole-2-carboxamide hydrochloride Traditional Name: 5-chloro-N-(diaminomethylene)-1-(4-pyridylmethyl)indole-2-carboxamide hydrochloride Formula: C16H15Cl2N5O MolecularWeight: 364.2292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C=C(N2CC3=CC=NC=C3)C(=O)N=C(N)N.Cl

Isomeric SMILES

C1=CC2=C(C=C1Cl)C=C(N2CC3=CC=NC=C3)C(=O)N=C(N)N.Cl

InChI

InChI=1S/C16H14ClN5O.ClH/c17-12-1-2-13-11(7-12)8-14(15(23)21-16(18)19)22(13)9-10-3-5-20-6-4-10;/h1-8H,9H2,(H4,18,19,21,23);1H