ethyl 5-(2-azanyl-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoate

Systemtic Name: ethyl 5-(2-azanyl-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoate Openeye Name: ethyl 5-(2-amino-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoate CAS Name: 5-(2-amino-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid ethyl ester IUPAC Name: ethyl 5-(2-amino-3a,4,6,6a-tetrahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoate Traditional Name: 5-(2-amino-3a,4,6,6a-tetrahydro-1H-thien[3,4-d]imidazol-4-yl)valeric acid ethyl ester Formula: C12H21N3O2S MolecularWeight: 271.37904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC1C2C(CS1)NC(=N2)N

Isomeric SMILES

CCOC(=O)CCCCC1C2C(CS1)NC(=N2)N

InChI

InChI=1S/C12H21N3O2S/c1-2-17-10(16)6-4-3-5-9-11-8(7-18-9)14-12(13)15-11/h8-9,11H,2-7H2,1H3,(H3,13,14,15)