prop-2-enyl (Z)-3-azanyl-2-[5-(imidazol-1-ylmethyl)thiophen-2-yl]but-2-enoate

Systemtic Name: prop-2-enyl (Z)-3-azanyl-2-[5-(imidazol-1-ylmethyl)thiophen-2-yl]but-2-enoate Openeye Name: allyl (Z)-3-amino-2-[5-(imidazol-1-ylmethyl)-2-thienyl]but-2-enoate CAS Name: (Z)-3-amino-2-[5-(1-imidazolylmethyl)-2-thiophenyl]-2-butenoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (Z)-3-amino-2-[5-(imidazol-1-ylmethyl)thiophen-2-yl]but-2-enoate Traditional Name: (Z)-3-amino-2-[5-(imidazol-1-ylmethyl)-2-thienyl]but-2-enoic acid allyl ester Formula: C15H17N3O2S MolecularWeight: 303.37938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C1=CC=C(S1)CN2C=CN=C2)C(=O)OCC=C)N

Isomeric SMILES

C/C(=C(/C1=CC=C(S1)CN2C=CN=C2)\C(=O)OCC=C)/N

InChI

InChI=1S/C15H17N3O2S/c1-3-8-20-15(19)14(11(2)16)13-5-4-12(21-13)9-18-7-6-17-10-18/h3-7,10H,1,8-9,16H2,2H3/b14-11+