1-but-2-ynyl-9-ethoxy-3,4-dihydro-2H-[1]benzothiolo[3,2-e][1,4]diazepin-5-one

Systemtic Name: 1-but-2-ynyl-9-ethoxy-3,4-dihydro-2H-[1]benzothiolo[3,2-e][1,4]diazepin-5-one Openeye Name: 1-but-2-ynyl-9-ethoxy-3,4-dihydro-2H-benzothiopheno[3,2-e][1,4]diazepin-5-one CAS Name: 1-but-2-ynyl-9-ethoxy-3,4-dihydro-2H-[1]benzothiolo[3,2-e][1,4]diazepin-5-one IUPAC Name: 1-but-2-ynyl-9-ethoxy-3,4-dihydro-2H-[1]benzothiolo[3,2-e][1,4]diazepin-5-one Traditional Name: 1-but-2-ynyl-9-ethoxy-3,4-dihydro-2H-benzothiopheno[3,2-e][1,4]diazepin-5-one Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)SC3=C2N(CCNC3=O)CC#CC

Isomeric SMILES

CCOC1=CC2=C(C=C1)SC3=C2N(CCNC3=O)CC#CC

InChI

InChI=1S/C17H18N2O2S/c1-3-5-9-19-10-8-18-17(20)16-15(19)13-11-12(21-4-2)6-7-14(13)22-16/h6-7,11H,4,8-10H2,1-2H3,(H,18,20)