N-cyclopropyl-3-[6-[(3R)-4-ethyl-3-methyl-piperazin-1-yl]-4-oxidanylidene-quinazolin-3-yl]-4-methyl-benzamide

Systemtic Name: N-cyclopropyl-3-[6-[(3R)-4-ethyl-3-methyl-piperazin-1-yl]-4-oxidanylidene-quinazolin-3-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[6-[(3R)-4-ethyl-3-methyl-piperazin-1-yl]-4-oxo-quinazolin-3-yl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[6-[(3R)-4-ethyl-3-methyl-1-piperazinyl]-4-oxo-3-quinazolinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[6-[(3R)-4-ethyl-3-methylpiperazin-1-yl]-4-oxoquinazolin-3-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[6-[(3R)-4-ethyl-3-methyl-piperazino]-4-keto-quinazolin-3-yl]-4-methyl-benzamide Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1C)C2=CC3=C(C=C2)N=CN(C3=O)C4=C(C=CC(=C4)C(=O)NC5CC5)C

Isomeric SMILES

CCN1CCN(C[C@H]1C)C2=CC3=C(C=C2)N=CN(C3=O)C4=C(C=CC(=C4)C(=O)NC5CC5)C

InChI

InChI=1S/C26H31N5O2/c1-4-29-11-12-30(15-18(29)3)21-9-10-23-22(14-21)26(33)31(16-27-23)24-13-19(6-5-17(24)2)25(32)28-20-7-8-20/h5-6,9-10,13-14,16,18,20H,4,7-8,11-12,15H2,1-3H3,(H,28,32)/t18-/m1/s1