3-azanyl-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-1,3-thiazol-2-yl]propanamide

Systemtic Name: 3-azanyl-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-1,3-thiazol-2-yl]propanamide Openeye Name: 3-amino-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-thiazol-2-yl]propanamide CAS Name: 3-amino-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-2-thiazolyl]propanamide IUPAC Name: 3-amino-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-1,3-thiazol-2-yl]propanamide Traditional Name: 3-amino-N-[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-thiazol-2-yl]propionamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)NC(=O)CCN)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=C(N=C(S1)NC(=O)CCN)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H19N3O3S/c1-10-15(19-16(23-10)18-14(20)5-6-17)11-3-4-12-13(9-11)22-8-2-7-21-12/h3-4,9H,2,5-8,17H2,1H3,(H,18,19,20)