(4S)-1-(anthracen-9-ylmethyl)-6-chloranyl-4-cyclopropyl-4-[2-(4-methoxyphenyl)ethynyl]-3H-quinazolin-2-one

Systemtic Name: (4S)-1-(anthracen-9-ylmethyl)-6-chloranyl-4-cyclopropyl-4-[2-(4-methoxyphenyl)ethynyl]-3H-quinazolin-2-one Openeye Name: (4S)-1-(9-anthrylmethyl)-6-chloro-4-cyclopropyl-4-[2-(4-methoxyphenyl)ethynyl]-3H-quinazolin-2-one CAS Name: (4S)-1-(9-anthracenylmethyl)-6-chloro-4-cyclopropyl-4-[2-(4-methoxyphenyl)ethynyl]-3H-quinazolin-2-one IUPAC Name: (4S)-1-(anthracen-9-ylmethyl)-6-chloro-4-cyclopropyl-4-[2-(4-methoxyphenyl)ethynyl]-3H-quinazolin-2-one Traditional Name: (4S)-1-(9-anthrylmethyl)-6-chloro-4-cyclopropyl-4-[2-(4-methoxyphenyl)ethynyl]-3H-quinazolin-2-one Formula: C35H27ClN2O2 MolecularWeight: 543.05408

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C#CC2(C3=C(C=CC(=C3)Cl)N(C(=O)N2)CC4=C5C=CC=CC5=CC6=CC=CC=C64)C7CC7

Isomeric SMILES

COC1=CC=C(C=C1)C#C[C@]2(C3=C(C=CC(=C3)Cl)N(C(=O)N2)CC4=C5C=CC=CC5=CC6=CC=CC=C64)C7CC7

InChI

InChI=1S/C35H27ClN2O2/c1-40-28-15-10-23(11-16-28)18-19-35(26-12-13-26)32-21-27(36)14-17-33(32)38(34(39)37-35)22-31-29-8-4-2-6-24(29)20-25-7-3-5-9-30(25)31/h2-11,14-17,20-21,26H,12-13,22H2,1H3,(H,37,39)/t35-/m1/s1