(4R)-3-(1-adamantyl)-6-azanyl-4-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: (4R)-3-(1-adamantyl)-6-azanyl-4-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: (4R)-3-(1-adamantyl)-6-amino-4-(2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: (4R)-3-(1-adamantyl)-6-amino-4-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: (4R)-3-(1-adamantyl)-6-amino-4-thiophen-2-yl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: (4R)-3-(1-adamantyl)-6-amino-4-(2-thienyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C4=C5C(C(=C(OC5=NN4)N)C#N)C6=CC=CS6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C4=C5[C@@H](C(=C(OC5=NN4)N)C#N)C6=CC=CS6

InChI

InChI=1S/C21H22N4OS/c22-10-14-16(15-2-1-3-27-15)17-18(24-25-20(17)26-19(14)23)21-7-11-4-12(8-21)6-13(5-11)9-21/h1-3,11-13,16H,4-9,23H2,(H,24,25)/t11?,12?,13?,16-,21?/m0/s1