(4S)-1-(anthracen-9-ylmethyl)-6-chloranyl-4-cyclopropyl-4-hex-1-ynyl-3H-quinazolin-2-one

Systemtic Name: (4S)-1-(anthracen-9-ylmethyl)-6-chloranyl-4-cyclopropyl-4-hex-1-ynyl-3H-quinazolin-2-one Openeye Name: (4S)-1-(9-anthrylmethyl)-6-chloro-4-cyclopropyl-4-hex-1-ynyl-3H-quinazolin-2-one CAS Name: (4S)-1-(9-anthracenylmethyl)-6-chloro-4-cyclopropyl-4-hex-1-ynyl-3H-quinazolin-2-one IUPAC Name: (4S)-1-(anthracen-9-ylmethyl)-6-chloro-4-cyclopropyl-4-hex-1-ynyl-3H-quinazolin-2-one Traditional Name: (4S)-1-(9-anthrylmethyl)-6-chloro-4-cyclopropyl-4-hex-1-ynyl-3H-quinazolin-2-one Formula: C32H29ClN2O MolecularWeight: 493.03846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1(C2=C(C=CC(=C2)Cl)N(C(=O)N1)CC3=C4C=CC=CC4=CC5=CC=CC=C53)C6CC6

Isomeric SMILES

CCCCC#C[C@]1(C2=C(C=CC(=C2)Cl)N(C(=O)N1)CC3=C4C=CC=CC4=CC5=CC=CC=C53)C6CC6

InChI

InChI=1S/C32H29ClN2O/c1-2-3-4-9-18-32(24-14-15-24)29-20-25(33)16-17-30(29)35(31(36)34-32)21-28-26-12-7-5-10-22(26)19-23-11-6-8-13-27(23)28/h5-8,10-13,16-17,19-20,24H,2-4,14-15,21H2,1H3,(H,34,36)/t32-/m1/s1