methyl 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]-methyl-amino]piperidin-1-yl]ethanoate

Systemtic Name: methyl 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]-methyl-amino]piperidin-1-yl]ethanoate Openeye Name: methyl 2-[4-[[4-(4-carbamimidoylphenyl)thiazol-2-yl]-methyl-amino]-1-piperidyl]acetate CAS Name: 2-[4-[[4-(4-carbamimidoylphenyl)-2-thiazolyl]-methylamino]-1-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-[[4-(4-carbamimidoylphenyl)-1,3-thiazol-2-yl]-methylamino]piperidin-1-yl]acetate Traditional Name: 2-[4-[[4-(4-amidinophenyl)thiazol-2-yl]-methyl-amino]piperidino]acetic acid methyl ester Formula: C19H25N5O2S MolecularWeight: 387.4991

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCN(CC1)CC(=O)OC)C2=NC(=CS2)C3=CC=C(C=C3)C(=N)N

Isomeric SMILES

CN(C1CCN(CC1)CC(=O)OC)C2=NC(=CS2)C3=CC=C(C=C3)C(=N)N

InChI

InChI=1S/C19H25N5O2S/c1-23(15-7-9-24(10-8-15)11-17(25)26-2)19-22-16(12-27-19)13-3-5-14(6-4-13)18(20)21/h3-6,12,15H,7-11H2,1-2H3,(H3,20,21)