N-(1H-indol-5-yl)-6-methoxy-7-[3-(1,2,4-triazol-1-yl)propoxy]quinazolin-4-amine

Systemtic Name: N-(1H-indol-5-yl)-6-methoxy-7-[3-(1,2,4-triazol-1-yl)propoxy]quinazolin-4-amine Openeye Name: N-(1H-indol-5-yl)-6-methoxy-7-[3-(1,2,4-triazol-1-yl)propoxy]quinazolin-4-amine CAS Name: N-(1H-indol-5-yl)-6-methoxy-7-[3-(1,2,4-triazol-1-yl)propoxy]-4-quinazolinamine IUPAC Name: N-(1H-indol-5-yl)-6-methoxy-7-[3-(1,2,4-triazol-1-yl)propoxy]quinazolin-4-amine Traditional Name: 1H-indol-5-yl-[6-methoxy-7-[3-(1,2,4-triazol-1-yl)propoxy]quinazolin-4-yl]amine Formula: C22H21N7O2 MolecularWeight: 415.44784

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)NC=C4)OCCCN5C=NC=N5

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC4=C(C=C3)NC=C4)OCCCN5C=NC=N5

InChI

InChI=1S/C22H21N7O2/c1-30-20-10-17-19(11-21(20)31-8-2-7-29-14-23-12-27-29)25-13-26-22(17)28-16-3-4-18-15(9-16)5-6-24-18/h3-6,9-14,24H,2,7-8H2,1H3,(H,25,26,28)