(4S)-6-azanyl-4-(5-bromanyl-2-prop-2-enoxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Systemtic Name: (4S)-6-azanyl-4-(5-bromanyl-2-prop-2-enoxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: (4S)-4-(2-allyloxy-5-bromo-phenyl)-6-amino-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: (4S)-6-amino-4-(5-bromo-2-prop-2-enoxyphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: (4S)-6-amino-4-(5-bromo-2-prop-2-enoxyphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: (4S)-4-(2-allyloxy-5-bromo-phenyl)-6-amino-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C17H15BrN4O2 MolecularWeight: 387.2306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=C(C=CC(=C3)Br)OCC=C

Isomeric SMILES

CC1=C2[C@H](C(=C(OC2=NN1)N)C#N)C3=C(C=CC(=C3)Br)OCC=C

InChI

InChI=1S/C17H15BrN4O2/c1-3-6-23-13-5-4-10(18)7-11(13)15-12(8-19)16(20)24-17-14(15)9(2)21-22-17/h3-5,7,15H,1,6,20H2,2H3,(H,21,22)/t15-/m0/s1