3-phenyl-N-prop-2-enyl-3,3a,4,5,6,7-hexahydroindazole-2-carbothioamide

Systemtic Name: 3-phenyl-N-prop-2-enyl-3,3a,4,5,6,7-hexahydroindazole-2-carbothioamide Openeye Name: N-allyl-3-phenyl-3,3a,4,5,6,7-hexahydroindazole-2-carbothioamide CAS Name: 3-phenyl-N-prop-2-enyl-3,3a,4,5,6,7-hexahydroindazole-2-carbothioamide IUPAC Name: 3-phenyl-N-prop-2-enyl-3,3a,4,5,6,7-hexahydroindazole-2-carbothioamide Traditional Name: N-allyl-3-phenyl-3,3a,4,5,6,7-hexahydroindazole-2-carbothioamide Formula: C17H21N3S MolecularWeight: 299.43374

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N1C(C2CCCCC2=N1)C3=CC=CC=C3

Isomeric SMILES

C=CCNC(=S)N1C(C2CCCCC2=N1)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3S/c1-2-12-18-17(21)20-16(13-8-4-3-5-9-13)14-10-6-7-11-15(14)19-20/h2-5,8-9,14,16H,1,6-7,10-12H2,(H,18,21)