1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(furan-2-ylmethyl)thiourea

Systemtic Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(2-furylmethyl)thiourea CAS Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[4-(3,4-dihydro-2H-quinolin-1-ylsulfonyl)phenyl]-3-(2-furfuryl)thiourea Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NCC4=CC=CO4

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)S(=O)(=O)C3=CC=C(C=C3)NC(=S)NCC4=CC=CO4

InChI

InChI=1S/C21H21N3O3S2/c25-29(26,24-13-3-6-16-5-1-2-8-20(16)24)19-11-9-17(10-12-19)23-21(28)22-15-18-7-4-14-27-18/h1-2,4-5,7-12,14H,3,6,13,15H2,(H2,22,23,28)