4-[3-(diethylamino)propoxy]-N7-ethyl-6-nitro-N2-(phenylmethyl)quinazoline-2,7-diamine

Systemtic Name: 4-[3-(diethylamino)propoxy]-N7-ethyl-6-nitro-N2-(phenylmethyl)quinazoline-2,7-diamine Openeye Name: N2-benzyl-4-[3-(diethylamino)propoxy]-N7-ethyl-6-nitro-quinazoline-2,7-diamine CAS Name: 4-[3-(diethylamino)propoxy]-N7-ethyl-6-nitro-N2-(phenylmethyl)quinazoline-2,7-diamine IUPAC Name: 2-N-benzyl-4-[3-(diethylamino)propoxy]-7-N-ethyl-6-nitroquinazoline-2,7-diamine Traditional Name: 3-[2-(benzylamino)-7-(ethylamino)-6-nitro-quinazolin-4-yl]oxypropyl-diethyl-amine Formula: C24H32N6O3 MolecularWeight: 452.54928

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C2C(=C1)N=C(N=C2OCCCN(CC)CC)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C2C(=C1)N=C(N=C2OCCCN(CC)CC)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C24H32N6O3/c1-4-25-21-16-20-19(15-22(21)30(31)32)23(33-14-10-13-29(5-2)6-3)28-24(27-20)26-17-18-11-8-7-9-12-18/h7-9,11-12,15-16,25H,4-6,10,13-14,17H2,1-3H3,(H,26,27,28)