2-(2-chloranylethanoylamino)-N-(furan-2-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-(2-chloranylethanoylamino)-N-(furan-2-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(2-chloroacetyl)amino]-N-(2-furylmethyl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(2-chloro-1-oxoethyl)amino]-N-(2-furanylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(2-chloroacetyl)amino]-N-(furan-2-ylmethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(2-chloroacetyl)amino]-N-(2-furfuryl)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C16H17ClN2O3S MolecularWeight: 352.83578

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)CCl)C(=O)NCC3=CC=CO3

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)CCl)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C16H17ClN2O3S/c17-8-13(20)19-16-14(11-5-1-2-6-12(11)23-16)15(21)18-9-10-4-3-7-22-10/h3-4,7H,1-2,5-6,8-9H2,(H,18,21)(H,19,20)