6-phenyl-2,3,6,11-tetrahydro-1H-pyrimido[2,1-c][2,4]benzothiazepine

Systemtic Name: 6-phenyl-2,3,6,11-tetrahydro-1H-pyrimido[2,1-c][2,4]benzothiazepine Openeye Name: 6-phenyl-2,3,6,11-tetrahydro-1H-pyrimido[2,1-c][2,4]benzothiazepine CAS Name: 6-phenyl-2,3,6,11-tetrahydro-1H-pyrimido[2,1-c][2,4]benzothiazepine IUPAC Name: 6-phenyl-2,3,6,11-tetrahydro-1H-pyrimido[2,1-c][2,4]benzothiazepine Traditional Name: 6-phenyl-2,3,6,11-tetrahydro-1H-pyrimido[2,1-c][2,4]benzothiazepine Formula: C18H18N2S MolecularWeight: 294.41392

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C2N(C1)CC3=CC=CC=C3C(S2)C4=CC=CC=C4

Isomeric SMILES

C1CN=C2N(C1)CC3=CC=CC=C3C(S2)C4=CC=CC=C4

InChI

InChI=1S/C18H18N2S/c1-2-7-14(8-3-1)17-16-10-5-4-9-15(16)13-20-12-6-11-19-18(20)21-17/h1-5,7-10,17H,6,11-13H2