6-azanyl-3-(phenylsulfanylmethyl)-4-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: 6-azanyl-3-(phenylsulfanylmethyl)-4-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: 6-amino-3-(phenylsulfanylmethyl)-4-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: 6-amino-3-[(phenylthio)methyl]-4-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: 6-amino-3-(phenylsulfanylmethyl)-4-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: 6-amino-3-[(phenylthio)methyl]-4-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1C(=C(OC2=NNC(=C12)CSC3=CC=CC=C3)N)C#N

Isomeric SMILES

CCCC1C(=C(OC2=NNC(=C12)CSC3=CC=CC=C3)N)C#N

InChI

InChI=1S/C17H18N4OS/c1-2-6-12-13(9-18)16(19)22-17-15(12)14(20-21-17)10-23-11-7-4-3-5-8-11/h3-5,7-8,12H,2,6,10,19H2,1H3,(H,20,21)