(4S)-4-(4-prop-2-enoxyphenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione

Systemtic Name: (4S)-4-(4-prop-2-enoxyphenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione Openeye Name: (4S)-4-(4-allyloxyphenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione CAS Name: (4S)-4-(4-prop-2-enoxyphenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione IUPAC Name: (4S)-4-(4-prop-2-enoxyphenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione Traditional Name: (4S)-4-(4-allyloxyphenyl)-4,4a,5,6-tetrahydro-3H-benzo[h]quinazoline-2-thione Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C2C3CCC4=CC=CC=C4C3=NC(=S)N2

Isomeric SMILES

C=CCOC1=CC=C(C=C1)[C@@H]2C3CCC4=CC=CC=C4C3=NC(=S)N2

InChI

InChI=1S/C21H20N2OS/c1-2-13-24-16-10-7-15(8-11-16)19-18-12-9-14-5-3-4-6-17(14)20(18)23-21(25)22-19/h2-8,10-11,18-19H,1,9,12-13H2,(H,22,25)/t18?,19-/m1/s1