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

Systemtic Name: (4S)-6-azanyl-4-(3-chloranyl-4-prop-2-ynoxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Openeye Name: (4S)-6-amino-4-(3-chloro-4-prop-2-ynoxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile CAS Name: (4S)-6-amino-4-(3-chloro-4-prop-2-ynoxyphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile IUPAC Name: (4S)-6-amino-4-(3-chloro-4-prop-2-ynoxyphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Traditional Name: (4S)-6-amino-4-(3-chloro-4-propargyloxy-phenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile Formula: C17H13ClN4O2 MolecularWeight: 340.76372

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN4O2/c1-3-6-23-13-5-4-10(7-12(13)18)15-11(8-19)16(20)24-17-14(15)9(2)21-22-17/h1,4-5,7,15H,6,20H2,2H3,(H,21,22)/t15-/m0/s1