azanyl 2,3-bis(azanyl)-4-(2-diethylaminoethyl)-2-methanethioyl-3-pyridin-3-yl-piperidine-1-carboxylate

Systemtic Name: azanyl 2,3-bis(azanyl)-4-(2-diethylaminoethyl)-2-methanethioyl-3-pyridin-3-yl-piperidine-1-carboxylate Openeye Name: amino 2,3-diamino-4-(2-diethylaminoethyl)-2-methanethioyl-3-(3-pyridyl)piperidine-1-carboxylate CAS Name: 2,3-diamino-4-(2-diethylaminoethyl)-2-methanethioyl-3-(3-pyridinyl)-1-piperidinecarboxylic acid amino ester IUPAC Name: amino 2,3-diamino-4-(2-diethylaminoethyl)-2-methanethioyl-3-pyridin-3-ylpiperidine-1-carboxylate Traditional Name: 2,3-diamino-4-(2-diethylaminoethyl)-3-(3-pyridyl)-2-thioformyl-piperidine-1-carboxylic acid amino ester Formula: C18H30N6O2S MolecularWeight: 394.5348

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1CCN(C(C1(C2=CN=CC=C2)N)(C=S)N)C(=O)ON

Isomeric SMILES

CCN(CC)CCC1CCN(C(C1(C2=CN=CC=C2)N)(C=S)N)C(=O)ON

InChI

InChI=1S/C18H30N6O2S/c1-3-23(4-2)10-7-14-8-11-24(16(25)26-21)17(19,13-27)18(14,20)15-6-5-9-22-12-15/h5-6,9,12-14H,3-4,7-8,10-11,19-21H2,1-2H3