ethanoic acid; 2-[(E)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]guanidine

Systemtic Name: ethanoic acid; 2-[(E)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]guanidine Openeye Name: acetic acid; 2-[(E)-[5-(1-piperidyl)-2-thienyl]methyleneamino]guanidine CAS Name: acetic acid; 2-[(E)-[5-(1-piperidinyl)-2-thiophenyl]methylideneamino]guanidine IUPAC Name: acetic acid; 2-[(E)-(5-piperidin-1-ylthiophen-2-yl)methylideneamino]guanidine Traditional Name: acetic acid; 2-[(E)-(5-piperidino-2-thienyl)methyleneamino]guanidine Formula: C13H21N5O2S MolecularWeight: 311.40314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1CCN(CC1)C2=CC=C(S2)C=NN=C(N)N

Isomeric SMILES

CC(=O)O.C1CCN(CC1)C2=CC=C(S2)/C=N/N=C(N)N

InChI

InChI=1S/C11H17N5S.C2H4O2/c12-11(13)15-14-8-9-4-5-10(17-9)16-6-2-1-3-7-16;1-2(3)4/h4-5,8H,1-3,6-7H2,(H4,12,13,15);1H3,(H,3,4)/b14-8+;