N-[(Z)-[2-oxidanylidene-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]thiophene-2-carboxamide

Systemtic Name: N-[(Z)-[2-oxidanylidene-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]thiophene-2-carboxamide Openeye Name: N-[(Z)-[2-oxo-1-(piperidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]thiophene-2-carboxamide CAS Name: N-[(Z)-[2-oxo-1-(1-piperidin-1-iumylmethyl)-3-indolylidene]amino]-2-thiophenecarboxamide IUPAC Name: N-[(Z)-[2-oxo-1-(piperidin-1-ium-1-ylmethyl)indol-3-ylidene]amino]thiophene-2-carboxamide Traditional Name: N-[(Z)-[2-keto-1-(piperidin-1-ium-1-ylmethyl)indolin-3-ylidene]amino]thiophene-2-carboxamide Formula: C19H21N4O2S+ MolecularWeight: 369.46064

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CN2C3=CC=CC=C3C(=NNC(=O)C4=CC=CS4)C2=O

Isomeric SMILES

C1CC[NH+](CC1)CN2C3=CC=CC=C3/C(=N/NC(=O)C4=CC=CS4)/C2=O

InChI

InChI=1S/C19H20N4O2S/c24-18(16-9-6-12-26-16)21-20-17-14-7-2-3-8-15(14)23(19(17)25)13-22-10-4-1-5-11-22/h2-3,6-9,12H,1,4-5,10-11,13H2,(H,21,24)/p+1/b20-17-