N-[3-(2-phenylazanyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)phenyl]prop-2-enamide

Systemtic Name: N-[3-(2-phenylazanyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)phenyl]prop-2-enamide Openeye Name: N-[3-(2-anilino-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)phenyl]prop-2-enamide CAS Name: N-[3-(2-anilino-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)phenyl]-2-propenamide IUPAC Name: N-[3-(2-anilino-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)phenyl]prop-2-enamide Traditional Name: N-[3-(2-anilino-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)phenyl]acrylamide Formula: C21H19N5O MolecularWeight: 357.40846

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)NC1=CC=CC(=C1)N2CCC3=CN=C(N=C32)NC4=CC=CC=C4

Isomeric SMILES

C=CC(=O)NC1=CC=CC(=C1)N2CCC3=CN=C(N=C32)NC4=CC=CC=C4

InChI

InChI=1S/C21H19N5O/c1-2-19(27)23-17-9-6-10-18(13-17)26-12-11-15-14-22-21(25-20(15)26)24-16-7-4-3-5-8-16/h2-10,13-14H,1,11-12H2,(H,23,27)(H,22,24,25)