5-chloranyl-6-[[2-[(4-cyanophenyl)amino]pyrimidin-4-yl]amino]-3H-indene-1-carbonitrile

Systemtic Name: 5-chloranyl-6-[[2-[(4-cyanophenyl)amino]pyrimidin-4-yl]amino]-3H-indene-1-carbonitrile Openeye Name: 5-chloro-6-[[2-(4-cyanoanilino)pyrimidin-4-yl]amino]-3H-indene-1-carbonitrile CAS Name: 5-chloro-6-[[2-(4-cyanoanilino)-4-pyrimidinyl]amino]-3H-indene-1-carbonitrile IUPAC Name: 5-chloro-6-[[2-(4-cyanoanilino)pyrimidin-4-yl]amino]-3H-indene-1-carbonitrile Traditional Name: 5-chloro-6-[[2-(4-cyanoanilino)pyrimidin-4-yl]amino]-3H-indene-1-carbonitrile Formula: C21H13ClN6 MolecularWeight: 384.82112

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(C2=CC(=C(C=C21)Cl)NC3=NC(=NC=C3)NC4=CC=C(C=C4)C#N)C#N

Isomeric SMILES

C1C=C(C2=CC(=C(C=C21)Cl)NC3=NC(=NC=C3)NC4=CC=C(C=C4)C#N)C#N

InChI

InChI=1S/C21H13ClN6/c22-18-9-14-3-4-15(12-24)17(14)10-19(18)27-20-7-8-25-21(28-20)26-16-5-1-13(11-23)2-6-16/h1-2,4-10H,3H2,(H2,25,26,27,28)