3-(aminocarbonylamino)-5-(4-cyanophenyl)-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide

Systemtic Name: 3-(aminocarbonylamino)-5-(4-cyanophenyl)-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide Openeye Name: 5-(4-cyanophenyl)-N-[(3S)-3-piperidyl]-3-ureido-thiophene-2-carboxamide CAS Name: 3-(carbamoylamino)-5-(4-cyanophenyl)-N-[(3S)-3-piperidinyl]-2-thiophenecarboxamide IUPAC Name: 3-(carbamoylamino)-5-(4-cyanophenyl)-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide Traditional Name: 5-(4-cyanophenyl)-N-[(3S)-3-piperidyl]-3-ureido-thiophene-2-carboxamide Formula: C18H19N5O2S MolecularWeight: 369.44076

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CNC1)NC(=O)C2=C(C=C(S2)C3=CC=C(C=C3)C#N)NC(=O)N

Isomeric SMILES

C1C[C@@H](CNC1)NC(=O)C2=C(C=C(S2)C3=CC=C(C=C3)C#N)NC(=O)N

InChI

InChI=1S/C18H19N5O2S/c19-9-11-3-5-12(6-4-11)15-8-14(23-18(20)25)16(26-15)17(24)22-13-2-1-7-21-10-13/h3-6,8,13,21H,1-2,7,10H2,(H,22,24)(H3,20,23,25)/t13-/m0/s1