N-[4-[2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[2-[2-(2-furylmethylamino)-2-oxo-ethyl]thiazol-4-yl]phenyl]-3-methyl-butanamide CAS Name: N-[4-[2-[2-(2-furanylmethylamino)-2-oxoethyl]-4-thiazolyl]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[2-[2-(furan-2-ylmethylamino)-2-oxoethyl]-1,3-thiazol-4-yl]phenyl]-3-methylbutanamide Traditional Name: N-[4-[2-[2-(2-furfurylamino)-2-keto-ethyl]thiazol-4-yl]phenyl]-3-methyl-butyramide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)CC(=O)NCC3=CC=CO3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C2=CSC(=N2)CC(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H23N3O3S/c1-14(2)10-20(26)23-16-7-5-15(6-8-16)18-13-28-21(24-18)11-19(25)22-12-17-4-3-9-27-17/h3-9,13-14H,10-12H2,1-2H3,(H,22,25)(H,23,26)