2-[[4-[4-(2-azanyl-4-methyl-pentanoyl)piperazin-1-yl]phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one

Systemtic Name: 2-[[4-[4-(2-azanyl-4-methyl-pentanoyl)piperazin-1-yl]phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one Openeye Name: 2-[4-[4-(2-amino-4-methyl-pentanoyl)piperazin-1-yl]anilino]-8-isopropyl-1H-quinazolin-7-one CAS Name: 2-[4-[4-(2-amino-4-methyl-1-oxopentyl)-1-piperazinyl]anilino]-8-propan-2-yl-1H-quinazolin-7-one IUPAC Name: 2-[4-[4-(2-amino-4-methylpentanoyl)piperazin-1-yl]anilino]-8-propan-2-yl-1H-quinazolin-7-one Traditional Name: 2-[4-[4-(2-amino-4-methyl-pentanoyl)piperazino]anilino]-8-isopropyl-1H-quinazolin-7-one Formula: C27H36N6O2 MolecularWeight: 476.61374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=CC(=O)C(=C4N3)C(C)C)N

Isomeric SMILES

CC(C)CC(C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC3=NC=C4C=CC(=O)C(=C4N3)C(C)C)N

InChI

InChI=1S/C27H36N6O2/c1-17(2)15-22(28)26(35)33-13-11-32(12-14-33)21-8-6-20(7-9-21)30-27-29-16-19-5-10-23(34)24(18(3)4)25(19)31-27/h5-10,16-18,22H,11-15,28H2,1-4H3,(H2,29,30,31)