1-[(E)-[5-azanyl-4-(morpholin-4-ylmethyl)pyridin-2-yl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[5-azanyl-4-(morpholin-4-ylmethyl)pyridin-2-yl]methylideneamino]thiourea Openeye Name: [(E)-[5-amino-4-(morpholinomethyl)-2-pyridyl]methyleneamino]thiourea CAS Name: [(E)-[5-amino-4-(4-morpholinylmethyl)-2-pyridinyl]methylideneamino]thiourea IUPAC Name: [(E)-[5-amino-4-(morpholin-4-ylmethyl)pyridin-2-yl]methylideneamino]thiourea Traditional Name: [(E)-[5-amino-4-(morpholinomethyl)-2-pyridyl]methyleneamino]thiourea Formula: C12H18N6OS MolecularWeight: 294.37592

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=CC(=NC=C2N)C=NNC(=S)N

Isomeric SMILES

C1COCCN1CC2=CC(=NC=C2N)/C=N/NC(=S)N

InChI

InChI=1S/C12H18N6OS/c13-11-7-15-10(6-16-17-12(14)20)5-9(11)8-18-1-3-19-4-2-18/h5-7H,1-4,8,13H2,(H3,14,17,20)/b16-6+