1-[2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-yl]-3-propan-2-yl-urea

Systemtic Name: 1-[2-[(4-piperazin-1-ylphenyl)amino]pyrido[2,3-d]pyrimidin-7-yl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]urea CAS Name: 1-[2-[4-(1-piperazinyl)anilino]-7-pyrido[2,3-d]pyrimidinyl]-3-propan-2-ylurea IUPAC Name: 1-[2-(4-piperazin-1-ylanilino)pyrido[2,3-d]pyrimidin-7-yl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[2-(4-piperazinoanilino)pyrido[2,3-d]pyrimidin-7-yl]urea Formula: C21H26N8O MolecularWeight: 406.48414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=NC2=NC(=NC=C2C=C1)NC3=CC=C(C=C3)N4CCNCC4

Isomeric SMILES

CC(C)NC(=O)NC1=NC2=NC(=NC=C2C=C1)NC3=CC=C(C=C3)N4CCNCC4

InChI

InChI=1S/C21H26N8O/c1-14(2)24-21(30)27-18-8-3-15-13-23-20(28-19(15)26-18)25-16-4-6-17(7-5-16)29-11-9-22-10-12-29/h3-8,13-14,22H,9-12H2,1-2H3,(H3,23,24,25,26,27,28,30)