(4S)-6-azanyl-4-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: (4S)-6-azanyl-4-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: (4S)-6-amino-4-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: (4S)-6-amino-4-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: (4S)-6-amino-4-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: (4S)-6-amino-4-(4-benzoxy-3-bromo-5-methoxy-phenyl)-3-propyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C24H23BrN4O3 MolecularWeight: 495.36842

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4)OC

Isomeric SMILES

CCCC1=C2[C@H](C(=C(OC2=NN1)N)C#N)C3=CC(=C(C(=C3)Br)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C24H23BrN4O3/c1-3-7-18-21-20(16(12-26)23(27)32-24(21)29-28-18)15-10-17(25)22(19(11-15)30-2)31-13-14-8-5-4-6-9-14/h4-6,8-11,20H,3,7,13,27H2,1-2H3,(H,28,29)/t20-/m0/s1