3-(aminocarbonylamino)-5-(3-fluorophenyl)-N-[(3S)-piperidin-1-ium-3-yl]thiophene-2-carboxamide

Systemtic Name: 3-(aminocarbonylamino)-5-(3-fluorophenyl)-N-[(3S)-piperidin-1-ium-3-yl]thiophene-2-carboxamide Openeye Name: 5-(3-fluorophenyl)-N-[(3S)-piperidin-1-ium-3-yl]-3-ureido-thiophene-2-carboxamide CAS Name: 3-(carbamoylamino)-5-(3-fluorophenyl)-N-[(3S)-3-piperidin-1-iumyl]-2-thiophenecarboxamide IUPAC Name: 3-(carbamoylamino)-5-(3-fluorophenyl)-N-[(3S)-piperidin-1-ium-3-yl]thiophene-2-carboxamide Traditional Name: 5-(3-fluorophenyl)-N-[(3S)-piperidin-1-ium-3-yl]-3-ureido-thiophene-2-carboxamide Formula: C17H20FN4O2S+ MolecularWeight: 363.429703

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)NC(=O)C2=C(C=C(S2)C3=CC(=CC=C3)F)NC(=O)N

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)NC(=O)C2=C(C=C(S2)C3=CC(=CC=C3)F)NC(=O)N

InChI

InChI=1S/C17H19FN4O2S/c18-11-4-1-3-10(7-11)14-8-13(22-17(19)24)15(25-14)16(23)21-12-5-2-6-20-9-12/h1,3-4,7-8,12,20H,2,5-6,9H2,(H,21,23)(H3,19,22,24)/p+1/t12-/m0/s1