N-[2-[(2S)-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[2-[(2S)-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[2-[(2S)-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]thiadiazole-4-carboxamide CAS Name: N-[2-[(2S)-2-(3-thiophenyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-4-thiadiazolecarboxamide IUPAC Name: N-[2-[(2S)-2-thiophen-3-yl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]thiadiazole-4-carboxamide Traditional Name: N-[2-[(2S)-2-(3-thienyl)-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]thiadiazole-4-carboxamide Formula: C18H18N4O2S2 MolecularWeight: 386.49112

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2CN1CCNC(=O)C3=CSN=N3)C4=CSC=C4

Isomeric SMILES

C1[C@@H](OC2=CC=CC=C2CN1CCNC(=O)C3=CSN=N3)C4=CSC=C4

InChI

InChI=1S/C18H18N4O2S2/c23-18(15-12-26-21-20-15)19-6-7-22-9-13-3-1-2-4-16(13)24-17(10-22)14-5-8-25-11-14/h1-5,8,11-12,17H,6-7,9-10H2,(H,19,23)/t17-/m1/s1