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

Systemtic Name: N-cyclopropyl-3-[6-[(3R)-4-(cyclopropylmethyl)-3-methyl-piperazin-1-yl]-4-oxidanylidene-quinazolin-3-yl]-4-methyl-benzamide Openeye Name: N-cyclopropyl-3-[6-[(3R)-4-(cyclopropylmethyl)-3-methyl-piperazin-1-yl]-4-oxo-quinazolin-3-yl]-4-methyl-benzamide CAS Name: N-cyclopropyl-3-[6-[(3R)-4-(cyclopropylmethyl)-3-methyl-1-piperazinyl]-4-oxo-3-quinazolinyl]-4-methylbenzamide IUPAC Name: N-cyclopropyl-3-[6-[(3R)-4-(cyclopropylmethyl)-3-methylpiperazin-1-yl]-4-oxoquinazolin-3-yl]-4-methylbenzamide Traditional Name: N-cyclopropyl-3-[6-[(3R)-4-(cyclopropylmethyl)-3-methyl-piperazino]-4-keto-quinazolin-3-yl]-4-methyl-benzamide Formula: C28H33N5O2 MolecularWeight: 471.59392

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC2CC2)C3=CC4=C(C=C3)N=CN(C4=O)C5=C(C=CC(=C5)C(=O)NC6CC6)C

Isomeric SMILES

C[C@@H]1CN(CCN1CC2CC2)C3=CC4=C(C=C3)N=CN(C4=O)C5=C(C=CC(=C5)C(=O)NC6CC6)C

InChI

InChI=1S/C28H33N5O2/c1-18-3-6-21(27(34)30-22-7-8-22)13-26(18)33-17-29-25-10-9-23(14-24(25)28(33)35)32-12-11-31(19(2)15-32)16-20-4-5-20/h3,6,9-10,13-14,17,19-20,22H,4-5,7-8,11-12,15-16H2,1-2H3,(H,30,34)/t19-/m1/s1