N-(2-aminophenyl)-6-[(3-butoxypropylcarbamoylamino)methyl]pyridine-3-carboxamide

Systemtic Name: N-(2-aminophenyl)-6-[(3-butoxypropylcarbamoylamino)methyl]pyridine-3-carboxamide Openeye Name: N-(2-aminophenyl)-6-[(3-butoxypropylcarbamoylamino)methyl]pyridine-3-carboxamide CAS Name: N-(2-aminophenyl)-6-[[[(3-butoxypropylamino)-oxomethyl]amino]methyl]-3-pyridinecarboxamide IUPAC Name: N-(2-aminophenyl)-6-[(3-butoxypropylcarbamoylamino)methyl]pyridine-3-carboxamide Traditional Name: N-(2-aminophenyl)-6-[(3-butoxypropylcarbamoylamino)methyl]nicotinamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCCNC(=O)NCC1=NC=C(C=C1)C(=O)NC2=CC=CC=C2N

Isomeric SMILES

CCCCOCCCNC(=O)NCC1=NC=C(C=C1)C(=O)NC2=CC=CC=C2N

InChI

InChI=1S/C21H29N5O3/c1-2-3-12-29-13-6-11-23-21(28)25-15-17-10-9-16(14-24-17)20(27)26-19-8-5-4-7-18(19)22/h4-5,7-10,14H,2-3,6,11-13,15,22H2,1H3,(H,26,27)(H2,23,25,28)