4-chloranyl-5,6-dihydro-[1]benzothiepino[5,4-d]pyrimidine

Systemtic Name: 4-chloranyl-5,6-dihydro-[1]benzothiepino[5,4-d]pyrimidine Openeye Name: 4-chloro-5,6-dihydro-[1]benzothiepino[5,4-d]pyrimidine CAS Name: 4-chloro-5,6-dihydro-[1]benzothiepino[5,4-d]pyrimidine IUPAC Name: 4-chloro-5,6-dihydro-[1]benzothiepino[5,4-d]pyrimidine Traditional Name: 4-chloro-5,6-dihydro-[1]benzothiepino[5,4-d]pyrimidine Formula: C12H9ClN2S MolecularWeight: 248.73126

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2C3=C1C(=NC=N3)Cl

Isomeric SMILES

C1CSC2=CC=CC=C2C3=C1C(=NC=N3)Cl

InChI

InChI=1S/C12H9ClN2S/c13-12-9-5-6-16-10-4-2-1-3-8(10)11(9)14-7-15-12/h1-4,7H,5-6H2