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

Systemtic Name: 2-[[4-[4-(2-azanylpentanoyl)piperazin-1-yl]phenyl]amino]-8-propan-2-yl-1H-quinazolin-7-one Openeye Name: 2-[4-[4-(2-aminopentanoyl)piperazin-1-yl]anilino]-8-isopropyl-1H-quinazolin-7-one CAS Name: 2-[4-[4-(2-amino-1-oxopentyl)-1-piperazinyl]anilino]-8-propan-2-yl-1H-quinazolin-7-one IUPAC Name: 2-[4-[4-(2-aminopentanoyl)piperazin-1-yl]anilino]-8-propan-2-yl-1H-quinazolin-7-one Traditional Name: 2-[4-[4-(2-aminopentanoyl)piperazino]anilino]-8-isopropyl-1H-quinazolin-7-one Formula: C26H34N6O2 MolecularWeight: 462.58716

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34N6O2/c1-4-5-21(27)25(34)32-14-12-31(13-15-32)20-9-7-19(8-10-20)29-26-28-16-18-6-11-22(33)23(17(2)3)24(18)30-26/h6-11,16-17,21H,4-5,12-15,27H2,1-3H3,(H2,28,29,30)