4-phenyl-N-[(Z)-1-pyrimidin-2-ylethylideneamino]piperidine-1-carbothioamide

Systemtic Name: 4-phenyl-N-[(Z)-1-pyrimidin-2-ylethylideneamino]piperidine-1-carbothioamide Openeye Name: 4-phenyl-N-[(Z)-1-pyrimidin-2-ylethylideneamino]piperidine-1-carbothioamide CAS Name: 4-phenyl-N-[(Z)-1-(2-pyrimidinyl)ethylideneamino]-1-piperidinecarbothioamide IUPAC Name: 4-phenyl-N-[(Z)-1-pyrimidin-2-ylethylideneamino]piperidine-1-carbothioamide Traditional Name: 4-phenyl-N-[(Z)-1-(2-pyrimidyl)ethylideneamino]piperidine-1-carbothioamide Formula: C18H21N5S MolecularWeight: 339.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)N1CCC(CC1)C2=CC=CC=C2)C3=NC=CC=N3

Isomeric SMILES

C/C(=N/NC(=S)N1CCC(CC1)C2=CC=CC=C2)/C3=NC=CC=N3

InChI

InChI=1S/C18H21N5S/c1-14(17-19-10-5-11-20-17)21-22-18(24)23-12-8-16(9-13-23)15-6-3-2-4-7-15/h2-7,10-11,16H,8-9,12-13H2,1H3,(H,22,24)/b21-14-